FP_ID	SMARTS	NAME
TEST_0	C	Single carbon
TEST_1	N	Single Nitrogen
FP3_1	[+]	1 cation
FP3_2	[-]	2 anion
FP3_3	[#6][CX3](=O)	3 aldehyde or ketone
FP3_4	[CX3H1](=O)[#6]	4 aldehyde
FP3_5	[#6][CX3](=O)[#6]	5 ketone
FP3_6	[#6][CX3](=S)	6 thioaldehyde or thioketone
FP3_7	[CX3H1](=S)	7 thioaldehyde
FP3_8	[#6]C(=[S])[#6]	8 thioketone
FP3_9	"[CX3]=N([#6,#1])[#6,#1]"	9 imine
FP3_10	"[#6,#1]C([#6,#1])=[N][N]([#6,#1])[#6,#1]"	10 hydrazone
FP3_11	"[#6,#1]C([#6,#1])=[N][N]([#6,#1])C(=[O])[N]([#6,#1])[#6,#1]"	11 semicarbazone
FP3_12	"[#6,#1]C([#6,#1])=[N][N]([#6,#1])C(=[S])[N]([#6,#1])[#6,#1]"	12 thiosemicarbazone
FP3_13	"[#6,#1]C([#6,#1])=[N][OH]"	13 oxime
FP3_14	"[#6,#1]C([#6,#1])=[N][O][#6]"	14 oxime ether
FP3_15	[CX3]=C=O	15 ketene
FP3_16	[CX3]=C=O	16 keten acetyl derivative***
FP3_17	"[#6,#1]C([#6,#1])([OH])([OH])"	17 carbonyl hydrate
FP3_18	"[#6,#1]C([#6,#1])([OH])(O[#6])"	18 hemiacetal
FP3_19	"[#6,#1]C([#6,#1])(O[#6])(O[#6])"	19 acetal
FP3_20	"[#6,#1]C([#6,#1])(N([#6,#1])[#6,#1])(O[#6])"	20 hemiaminal
FP3_21	"[#6,#1]C([#6,#1])(N([#6,#1])[#6,#1])(N([#6,#1])[#6,#1])"	21 aminal
FP3_22	"[#6,#1]C([#6,#1])(N([#6,#1])[#6,#1])([S][#6])"	22 thiohemiaminal
FP3_23	"[#6,#1]C([#6,#1])([S][#6])([S][#6])"	23 thioacetal
FP3_24	"[#6,#1]C([#6,#1])=C([#6,#1])N([#6,#1])[#6,#1]"	24 enamine
FP3_25	"[#6,#1]C([#6,#1])=C([#6,#1])[OH]"	25 enol
FP3_26	"[#6,#1]C([#6,#1])=C([#6,#1])O[#6]"	26 enol ether
FP3_27	[#6][OH]	27 hydroxy compound
FP3_28	C[OH]	28 alcohol
FP3_29	[#6][CH2][OH]	29 primary alcohol
FP3_30	[#6][CH]([#6])[OH]	30 secondary alcohol
FP3_31	[#6][C]([#6])([#6])[OH]	31 tertiary alcohol
FP3_32	"[#6,#1]C([#6,#1])([OH])C([#6,#1])([#6,#1])[OH]"	"32 1,2-diol"
FP3_33	"[#6,#1]C([#6,#1])([OH])C([#6,#1])([#6,#1])[NH2]"	"33 1,2-aminoalcohol"
FP3_34	c[OH]	34 phenol
FP3_35	[OH]cc[OH]	"35 1,2-diphenol"
FP3_36	[OH]C=C[OH]	36 enediol
FP3_37	[#6]O[#6]	37 ether
FP3_38	COC	38 dialkyl ether
FP3_39	cOC	9 alkylaryl ether
FP3_40	cOc	40 diaryl ether
FP3_41	[#6]S[#6]	41 thioether
FP3_42	[#6]SS[#6]	42 disulfide
FP3_43	[#6]OO[#6]	43 peroxide
FP3_44	[#6]O[OH]	44 hydroperoxide
FP3_45	[a]	200 aryl
FP3_46	"[!#6;$([N,O,S,F,Cl,Br,I,P])]"	201 heteroatom
FP3_47	"[!#6;!$([+0]);!$([F,Cl,Br,I]);!$([o,s,nX3]);!$([Nv5,Pv5,Sv4,Sv6])]"	202 HBA
FP3_48	"[$([N,O;!H0]),$(N(C)(C)C)]"	203 HBD
FP3_49	[R]	204 Ring
FP3_50	"[$([$([C;$(C=[$([O;D1;$(O=C)])])]);$(C[$([O;$([H1&-0,H0&-1])])]);$(C[#6,#1])])]"	205 carboxylic acid
FP3_51	"[$([$([C;$(C=[$([O;D1;$(O=C)])])]);$(C(=O)O[#6]);$(C[#6,#1])])]"	206 ester
FP3_52	"[$([N;+0,+1;$(N(=O)~[O;H0;-0,-1])])]"	207 nitro
FP3_53	[$([C;$(C#[N;D1])])]	208 nitrile
FP3_54	[$([N;!$(N*=[!#6])]);$(N[$([a])]);!$(N~[!#6])]	209 aniline
FP3_55	[$([N;$(N[$([$([C;$(C=[$([O;D1;$(O=C)])])]);$(C(=O)(N)N)])])])]	210 urea
FP3_56		
FP4_1	[CX4H3][#6]	Primary_carbon
FP4_2	[CX4H2]([#6])[#6]	Secondary_carbon
FP4_3	[CX4H1]([#6])([#6])[#6]	Tertiary_carbon
FP4_4	[CX4]([#6])([#6])([#6])[#6]	Quaternary_carbon
FP4_5	"[CX3;$([H2]),$([H1][#6]),$(C([#6])[#6])]=[CX3;$([H2]),$([H1][#6]),$(C([#6])[#6])]"	Alkene
FP4_6	[CX2]#[CX2]	Alkyne
FP4_7	[CX3]=[CX2]=[CX3]	Allene
FP4_8	[ClX1][CX4]	Alkylchloride
FP4_9	[FX1][CX4]	Alkylfluoride
FP4_10	[BrX1][CX4]	Alkylbromide
FP4_11	[IX1][CX4]	Alkyliodide
FP4_12	"[OX2H][CX4;!$(C([OX2H])[O,S,#7,#15])]"	Alcohol
FP4_13	"[OX2H][CX4H2;!$(C([OX2H])[O,S,#7,#15])]"	Primary_alcohol
FP4_14	"[OX2H][CX4H;!$(C([OX2H])[O,S,#7,#15])]"	Secondary_alcohol
FP4_15	"[OX2H][CX4D4;!$(C([OX2H])[O,S,#7,#15])]"	Tertiary_alcohol
FP4_16	"[OX2]([CX4;!$(C([OX2])[O,S,#7,#15,F,Cl,Br,I])])[CX4;!$(C([OX2])[O,S,#7,#15])]"	Dialkylether
FP4_17	"[SX2]([CX4;!$(C([OX2])[O,S,#7,#15,F,Cl,Br,I])])[CX4;!$(C([OX2])[O,S,#7,#15])]"	Dialkylthioether
FP4_18	"[OX2](c)[CX4;!$(C([OX2])[O,S,#7,#15,F,Cl,Br,I])]"	Alkylarylether
FP4_19	[c][OX2][c]	Diarylether
FP4_20	"[SX2](c)[CX4;!$(C([OX2])[O,S,#7,#15,F,Cl,Br,I])]"	Alkylarylthioether
FP4_21	[c][SX2][c]	Diarylthioether
FP4_22	"[O+;!$([O]~[!#6]);!$([S]*~[#7,#8,#15,#16])]"	Oxonium
FP4_23	"[NX3+0,NX4+;!$([N]~[!#6]);!$([N]*~[#7,#8,#15,#16])]"	Amine
FP4_24	"[NX3H2+0,NX4H3+;!$([N][!C]);!$([N]*~[#7,#8,#15,#16])]"	Primary_aliph_amine
FP4_25	"[NX3H1+0,NX4H2+;!$([N][!C]);!$([N]*~[#7,#8,#15,#16])]"	Secondary_aliph_amine
FP4_26	"[NX3H0+0,NX4H1+;!$([N][!C]);!$([N]*~[#7,#8,#15,#16])]"	Tertiary_aliph_amine
FP4_27	"[NX4H0+;!$([N][!C]);!$([N]*~[#7,#8,#15,#16])]"	Quaternary_aliph_ammonium
FP4_28	"[NX3H2+0,NX4H3+]c"	Primary_arom_amine
FP4_29	"[NX3H1+0,NX4H2+;!$([N][!c]);!$([N]*~[#7,#8,#15,#16])]"	Secondary_arom_amine
FP4_30	"[NX3H0+0,NX4H1+;!$([N][!c]);!$([N]*~[#7,#8,#15,#16])]"	Tertiary_arom_amine
FP4_31	"[NX4H0+;!$([N][!c]);!$([N]*~[#7,#8,#15,#16])]"	Quaternary_arom_ammonium
FP4_32	"[NX3H1+0,NX4H2+;$([N]([c])[C]);!$([N]*~[#7,#8,#15,#16])]"	Secondary_mixed_amine
FP4_33	"[NX3H0+0,NX4H1+;$([N]([c])([C])[#6]);!$([N]*~[#7,#8,#15,#16])]"	Tertiary_mixed_amine
FP4_34	"[NX4H0+;$([N]([c])([C])[#6][#6]);!$([N]*~[#7,#8,#15,#16])]"	Quaternary_mixed_ammonium
FP4_35	"[N+;!$([N]~[!#6]);!$(N=*);!$([N]*~[#7,#8,#15,#16])]"	Ammonium
FP4_36	"[SX2H][CX4;!$(C([SX2H])~[O,S,#7,#15])]"	Alkylthiol
FP4_37	"[SX2]([CX4;!$(C([SX2])[O,S,#7,#15,F,Cl,Br,I])])[CX4;!$(C([SX2])[O,S,#7,#15])]"	Dialkylthioether
FP4_38	"[SX2](c)[CX4;!$(C([SX2])[O,S,#7,#15])]"	Alkylarylthioether
FP4_39	[SX2D2][SX2D2]	Disulfide
FP4_40	"[OX2H][CX4;!$(C([OX2H])[O,S,#7,#15,F,Cl,Br,I])][CX4;!$(C([N])[O,S,#7,#15])][NX3;!$(NC=[O,S,N])]"	"1,2-Aminoalcohol"
FP4_41	"[OX2H][CX4;!$(C([OX2H])[O,S,#7,#15])][CX4;!$(C([OX2H])[O,S,#7,#15])][OX2H]"	"1,2-Diol"
FP4_42	"[OX2H][CX4;!$(C([OX2H])([OX2H])[O,S,#7,#15])][OX2H]"	"1,1-Diol"
FP4_43	[OX2H][OX2]	Hydroperoxide
FP4_44	[OX2D2][OX2D2]	Peroxo
FP4_45	"[LiX1][#6,#14]"	Organolithium_compounds
FP4_46	"[MgX2][#6,#14]"	Organomagnesium_compounds
FP4_47	[!#1;!#5;!#6;!#7;!#8;!#9;!#14;!#15;!#16;!#17;!#33;!#34;!#35;!#52;!#53;!#85]~[#6;!-]	Organometallic_compounds
FP4_48	"[$([CX3H][#6]),$([CX3H2])]=[OX1]"	Aldehyde
FP4_49	[#6][CX3](=[OX1])[#6]	Ketone
FP4_50	"[$([CX3H][#6]),$([CX3H2])]=[SX1]"	Thioaldehyde
FP4_51	[#6][CX3](=[SX1])[#6]	Thioketone
FP4_52	"[NX2;$([N][#6]),$([NH]);!$([N][CX3]=[#7,#8,#15,#16])]=[CX3;$([CH2]),$([CH][#6]),$([C]([#6])[#6])]"	Imine
FP4_53	"[NX3+;!$([N][!#6]);!$([N][CX3]=[#7,#8,#15,#16])]"	Immonium
FP4_54	"[NX2](=[CX3;$([CH2]),$([CH][#6]),$([C]([#6])[#6])])[OX2H]"	Oxime
FP4_55	"[NX2](=[CX3;$([CH2]),$([CH][#6]),$([C]([#6])[#6])])[OX2][#6;!$(C=[#7,#8])]"	Oximether
FP4_56	"[OX2]([#6;!$(C=[O,S,N])])[CX4;!$(C(O)(O)[!#6])][OX2][#6;!$(C=[O,S,N])]"	Acetal
FP4_57	"[OX2H][CX4;!$(C(O)(O)[!#6])][OX2][#6;!$(C=[O,S,N])]"	Hemiacetal
FP4_58	"[NX3v3;!$(NC=[#7,#8,#15,#16])]([#6])[CX4;!$(C(N)(N)[!#6])][NX3v3;!$(NC=[#7,#8,#15,#16])][#6]"	Aminal
FP4_59	"[NX3v3;!$(NC=[#7,#8,#15,#16])]([#6])[CX4;!$(C(N)(N)[!#6])][OX2H]"	Hemiaminal
FP4_60	"[SX2]([#6;!$(C=[O,S,N])])[CX4;!$(C(S)(S)[!#6])][SX2][#6;!$(C=[O,S,N])]"	Thioacetal
FP4_61	"[SX2]([#6;!$(C=[O,S,N])])[CX4;!$(C(S)(S)[!#6])][OX2H]"	Thiohemiacetal
FP4_62	"[NX3v3,SX2,OX2;!$(*C=[#7,#8,#15,#16])][CX4;!$(C([N,S,O])([N,S,O])[!#6])][FX1,ClX1,BrX1,IX1]"	Halogen_acetal_like
FP4_63	"[NX3v3,SX2,OX2;!$(*C=[#7,#8,#15,#16])][CX4;!$(C([N,S,O])([N,S,O])[!#6])][FX1,ClX1,BrX1,IX1,NX3v3,SX2,OX2;!$(*C=[#7,#8,#15,#16])]"	Acetal_like
FP4_64	"[NX3v3,SX2,OX2;$(**=[#7,#8,#15,#16])][CX4;!$(C([N,S,O])([N,S,O])[!#6])][FX1,ClX1,BrX1,IX1]"	Halogenmethylen_ester_and_similar
FP4_65	"[NX3v3,SX2,OX2;$(**=[#7,#8,#15,#16])][CX4;!$(C([N,S,O])([N,S,O])[!#6])][NX3v3,SX2,OX2;!$(*C=[#7,#8,#15,#16])]"	NOS_methylen_ester_and_similar
FP4_66	"[NX3v3,SX2,OX2;$(**=[#7,#8,#15,#16])][CX4;!$(C([N,S,O])([N,S,O])[!#6])][FX1,ClX1,BrX1,IX1,NX3v3,SX2,OX2;!$(*C=[#7,#8,#15,#16])]"	Hetero_methylen_ester_and_similar
FP4_67	"[NX1]#[CX2][CX4;$([CH2]),$([CH]([CX2])[#6]),$(C([CX2])([#6])[#6])][OX2H]"	Cyanhydrine
FP4_68	[ClX1][CX3]=[CX3]	Chloroalkene
FP4_69	[FX1][CX3]=[CX3]	Fluoroalkene
FP4_70	[BrX1][CX3]=[CX3]	Bromoalkene
FP4_71	[IX1][CX3]=[CX3]	Iodoalkene
FP4_72	"[OX2H][CX3;$([H1]),$(C[#6])]=[CX3]"	Enol
FP4_73	"[OX2H][CX3;$([H1]),$(C[#6])]=[CX3;$([H1]),$(C[#6])][OX2H]"	Endiol
FP4_74	"[OX2]([#6;!$(C=[N,O,S])])[CX3;$([H0][#6]),$([H1])]=[CX3]"	Enolether
FP4_75	"[OX2]([CX3]=[OX1])[#6X3;$([#6][#6]),$([H1])]=[#6X3;!$(C[OX2H])]"	Enolester
FP4_76	"[NX3;$([NH2][CX3]),$([NH1]([CX3])[#6]),$([N]([CX3])([#6])[#6]);!$([N]*=[#7,#8,#15,#16])][CX3;$([CH]),$([C][#6])]=[CX3]"	Enamine
FP4_77	"[SX2H][CX3;$([H1]),$(C[#6])]=[CX3]"	Thioenol
FP4_78	"[SX2]([#6;!$(C=[N,O,S])])[CX3;$(C[#6]),$([CH])]=[CX3]"	Thioenolether
FP4_79	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[ClX1]"	Acylchloride
FP4_80	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[FX1]"	Acylfluoride
FP4_81	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[BrX1]"	Acylbromide
FP4_82	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[IX1]"	Acyliodide
FP4_83	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[FX1,ClX1,BrX1,IX1]"	Acylhalide
FP4_84	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[$([OX2H]),$([OX1-])]"	Carboxylic_acid
FP4_85	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[OX2][#6;!$(C=[O,N,S])]"	Carboxylic_ester
FP4_86	"[#6][#6X3R](=[OX1])[#8X2][#6;!$(C=[O,N,S])]"	Lactone
FP4_87	"[CX3;$([H0][#6]),$([H1])](=[OX1])[#8X2][CX3;$([H0][#6]),$([H1])](=[OX1])"	Carboxylic_anhydride
FP4_88	"[$([#6X3H0][#6]),$([#6X3H])](=[!#6])[!#6]"	Carboxylic_acid_derivative
FP4_89	"[CX3;!R;$([C][#6]),$([CH]);$([C](=[OX1])[$([SX2H]),$([SX1-])]),$([C](=[SX1])[$([OX2H]),$([OX1-])])]"	Carbothioic_acid
FP4_90	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[SX2][#6;!$(C=[O,N,S])]"	Carbothioic_S_ester
FP4_91	"[#6][#6X3R](=[OX1])[#16X2][#6;!$(C=[O,N,S])]"	Carbothioic_S_lactone
FP4_92	"[CX3;$([H0][#6]),$([H1])](=[SX1])[OX2][#6;!$(C=[O,N,S])]"	Carbothioic_O_ester
FP4_93	"[#6][#6X3R](=[SX1])[#8X2][#6;!$(C=[O,N,S])]"	Carbothioic_O_lactone
FP4_94	"[CX3;$([H0][#6]),$([H1])](=[SX1])[FX1,ClX1,BrX1,IX1]"	Carbothioic_halide
FP4_95	"[CX3;!R;$([C][#6]),$([CH]);$([C](=[SX1])[SX2H])]"	Carbodithioic_acid
FP4_96	"[CX3;!R;$([C][#6]),$([CH]);$([C](=[SX1])[SX2][#6;!$(C=[O,N,S])])]"	Carbodithioic_ester
FP4_97	"[#6][#6X3R](=[SX1])[#16X2][#6;!$(C=[O,N,S])]"	Carbodithiolactone
FP4_98	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Amide
FP4_99	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[NX3H2]"	Primary_amide
FP4_100	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[#7X3H1][#6;!$(C=[O,N,S])]"	Secondary_amide
FP4_101	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[#7X3H0]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])]"	Tertiary_amide
FP4_102	"[#6R][#6X3R](=[OX1])[#7X3;$([H1][#6;!$(C=[O,N,S])]),$([H0]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Lactam
FP4_103	"[#6X3;$([H0][#6]),$([H1])](=[OX1])[#7X3H0]([#6])[#6X3;$([H0][#6]),$([H1])](=[OX1])"	Alkyl_imide
FP4_104	"[#6X3;$([H0][#6]),$([H1])](=[OX1])[#7X3H0]([!#6])[#6X3;$([H0][#6]),$([H1])](=[OX1])"	N_hetero_imide
FP4_105	"[#6X3;$([H0][#6]),$([H1])](=[OX1])[#7X3H1][#6X3;$([H0][#6]),$([H1])](=[OX1])"	Imide_acidic
FP4_106	"[$([CX3;!R][#6]),$([CX3H;!R])](=[SX1])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Thioamide
FP4_107	"[#6R][#6X3R](=[SX1])[#7X3;$([H1][#6;!$(C=[O,N,S])]),$([H0]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Thiolactam
FP4_108	"[#6X3;$([H0][#6]),$([H1])](=[OX1])[#8X2][#7X2]=,:[#6X3;$([H0]([#6])[#6]),$([H1][#6]),$([H2])]"	Oximester
FP4_109	"[NX3;!$(NC=[O,S])][CX3;$([CH]),$([C][#6])]=[NX2;!$(NC=[O,S])]"	Amidine
FP4_110	"[CX3;$([H0][#6]),$([H1])](=[OX1])[#7X3;$([H1]),$([H0][#6;!$(C=[O,N,S])])][$([OX2H]),$([OX1-])]"	Hydroxamic_acid
FP4_111	"[CX3;$([H0][#6]),$([H1])](=[OX1])[#7X3;$([H1]),$([H0][#6;!$(C=[O,N,S])])][OX2][#6;!$(C=[O,N,S])]"	Hydroxamic_acid_ester
FP4_112	"[CX3R0;$([H0][#6]),$([H1])](=[NX2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[$([OX2H]),$([OX1-])]"	Imidoacid
FP4_113	"[#6R][#6X3R](=,:[#7X2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[$([OX2H]),$([OX1-])]"	Imidoacid_cyclic
FP4_114	"[CX3R0;$([H0][#6]),$([H1])](=[NX2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[OX2][#6;!$(C=[O,N,S])]"	Imidoester
FP4_115	"[#6R][#6X3R](=,:[#7X2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[OX2][#6;!$(C=[O,N,S])]"	Imidolactone
FP4_116	"[CX3R0;$([H0][#6]),$([H1])](=[NX2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[$([SX2H]),$([SX1-])]"	Imidothioacid
FP4_117	"[#6R][#6X3R](=,:[#7X2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[$([SX2H]),$([SX1-])]"	Imidothioacid_cyclic
FP4_118	"[CX3R0;$([H0][#6]),$([H1])](=[NX2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[SX2][#6;!$(C=[O,N,S])]"	Imidothioester
FP4_119	"[#6R][#6X3R](=,:[#7X2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[SX2][#6;!$(C=[O,N,S])]"	Imidothiolactone
FP4_120	"[#7X3v3;!$(N([#6X3]=[#7X2])C=[O,S])][CX3R0;$([H1]),$([H0][#6])]=[NX2v3;!$(N(=[#6X3][#7X3])C=[O,S])]"	Amidine
FP4_121	"[#6][#6X3R;$([H0](=[NX2;!$(N(=[#6X3][#7X3])C=[O,S])])[#7X3;!$(N([#6X3]=[#7X2])C=[O,S])]),$([H0](-[NX3;!$(N([#6X3]=[#7X2])C=[O,S])])=,:[#7X2;!$(N(=[#6X3][#7X3])C=[O,S])])]"	Imidolactam
FP4_122	"[CX3R0;$([H0][#6]),$([H1])](=[NX2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[FX1,ClX1,BrX1,IX1]"	Imidoylhalide
FP4_123	"[#6R][#6X3R](=,:[#7X2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[FX1,ClX1,BrX1,IX1]"	Imidoylhalide_cyclic
FP4_124	"[$([$([#6X3][#6]),$([#6X3H])](=[#7X2v3])[#7X3v3][#7X3v3]),$([$([#6X3][#6]),$([#6X3H])]([#7X3v3])=[#7X2v3][#7X3v3])]"	Amidrazone
FP4_125	"[NX3,NX4+;!$([N]~[!#6]);!$([N]*~[#7,#8,#15,#16])][C][CX3](=[OX1])[OX2H,OX1-]"	Alpha_aminoacid
FP4_126	"[OX2H][C][CX3](=[OX1])[OX2H,OX1-]"	Alpha_hydroxyacid
FP4_127	"[NX3;$([N][CX3](=[OX1])[C][NX3,NX4+])][C][CX3](=[OX1])[NX3;$([N][C][CX3](=[OX1])[NX3,OX2,OX1-])]"	Peptide_middle
FP4_128	"[NX3;$([N][CX3](=[OX1])[C][NX3,NX4+])][C][CX3](=[OX1])[OX2H,OX1-]"	Peptide_C_term
FP4_129	"[NX3,NX4+;!$([N]~[!#6]);!$([N]*~[#7,#8,#15,#16])][C][CX3](=[OX1])[NX3;$([N][C][CX3](=[OX1])[NX3,OX2,OX1-])]Carboxylic_orthoester: [#6][OX2][CX4;$(C[#6]),$([CH])]([OX2][#6])[OX2][#6]"	Peptide_N_term
FP4_130	[CX3]=[CX2]=[OX1]	Ketene
FP4_131	"[#7X2,#8X3,#16X2;$(*[#6,#14])][#6X3]([#7X2,#8X3,#16X2;$(*[#6,#14])])=[#6X3]"	Ketenacetal
FP4_132	[NX1]#[CX2]	Nitrile
FP4_133	[CX1-]#[NX2+]	Isonitrile
FP4_134	"[#6X3](=[OX1])[#6X3]=,:[#6X3][#7,#8,#16,F,Cl,Br,I]"	Vinylogous_carbonyl_or_carboxyl_derivative
FP4_135	"[#6X3](=[OX1])[#6X3]=,:[#6X3][$([OX2H]),$([OX1-])]"	Vinylogous_acid
FP4_136	"[#6X3](=[OX1])[#6X3]=,:[#6X3][#6;!$(C=[O,N,S])]"	Vinylogous_ester
FP4_137	"[#6X3](=[OX1])[#6X3]=,:[#6X3][#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Vinylogous_amide
FP4_138	"[#6X3](=[OX1])[#6X3]=,:[#6X3][FX1,ClX1,BrX1,IX1]"	Vinylogous_halide
FP4_139	"[#6;!$(C=[O,N,S])][#8X2][#6X3](=[OX1])[#8X2][#6;!$(C=[O,N,S])]"	Carbonic_acid_dieester
FP4_140	"[#6;!$(C=[O,N,S])][OX2;!R][CX3](=[OX1])[OX2][FX1,ClX1,BrX1,IX1]"	Carbonic_acid_esterhalide
FP4_141	"[#6;!$(C=[O,N,S])][OX2;!R][CX3](=[OX1])[$([OX2H]),$([OX1-])]"	Carbonic_acid_monoester
FP4_142	[!#6][#6X3](=[!#6])[!#6]	Carbonic_acid_derivatives
FP4_143	"[#6;!$(C=[O,N,S])][#8X2][#6X3](=[SX1])[#8X2][#6;!$(C=[O,N,S])]"	Thiocarbonic_acid_dieester
FP4_144	"[#6;!$(C=[O,N,S])][OX2;!R][CX3](=[SX1])[OX2][FX1,ClX1,BrX1,IX1]"	Thiocarbonic_acid_esterhalide
FP4_145	"[#6;!$(C=[O,N,S])][OX2;!R][CX3](=[SX1])[$([OX2H]),$([OX1-])]"	Thiocarbonic_acid_monoester
FP4_146	[#7X3;!$([#7][!#6])][#6X3](=[SX1])[#7X3;!$([#7][!#6])]	Thiourea
FP4_147	"[#7X2;!$([#7][!#6])]=,:[#6X3]([#8X2&!$([#8][!#6]),OX1-])[#7X3;!$([#7][!#6])]"	Isourea
FP4_148	"[#7X2;!$([#7][!#6])]=,:[#6X3]([#16X2&!$([#16][!#6]),SX1-])[#7X3;!$([#7][!#6])]"	Isothiourea
FP4_149	"[N;v3X3,v4X4+][CX3](=[N;v3X2,v4X3+])[N;v3X3,v4X4+]"	Guanidine
FP4_150	"[NX3]C(=[OX1])[O;X2H,X1-]"	Carbaminic_acid
FP4_151	[#7X3][#6](=[OX1])[#8X2][#6]	Urethan
FP4_152	[#7X3][#6](=[OX1])[#7X3][#6](=[OX1])[#7X3]	Biuret
FP4_153	[#7X3][#7X3][#6X3]([#7X3;!$([#7][#7])])=[OX1]	Semicarbazide
FP4_154	[#7X3][#7X3][#6X3]([#7X3][#7X3])=[OX1]	Carbazide
FP4_155	[#7X2](=[#6])[#7X3][#6X3]([#7X3;!$([#7][#7])])=[OX1]	Semicarbazone
FP4_156	[#7X2](=[#6])[#7X3][#6X3]([#7X3][#7X3])=[OX1]	Carbazone
FP4_157	[#7X3][#7X3][#6X3]([#7X3;!$([#7][#7])])=[SX1]	Thiosemicarbazide
FP4_158	[#7X3][#7X3][#6X3]([#7X3][#7X3])=[SX1]	Thiocarbazide
FP4_159	[#7X2](=[#6])[#7X3][#6X3]([#7X3;!$([#7][#7])])=[SX1]	Thiosemicarbazone
FP4_160	[#7X2](=[#6])[#7X3][#6X3]([#7X3][#7X3])=[SX1]	Thiocarbazone
FP4_161	[NX2]=[CX2]=[OX1]	Isocyanate
FP4_162	[OX2][CX2]#[NX1]	Cyanate
FP4_163	[NX2]=[CX2]=[SX1]	Isothiocyanate
FP4_164	[SX2][CX2]#[NX1]	Thiocyanate
FP4_165	[NX2]=[CX2]=[NX2]	Carbodiimide
FP4_166	"[CX4H0]([O,S,#7])([O,S,#7])([O,S,#7])[O,S,#7,F,Cl,Br,I]"	Orthocarbonic_derivatives
FP4_167	[OX2H][c]	Phenol
FP4_168	[OX2H][c][c][OX2H]	"1,2-Diphenol"
FP4_169	[Cl][c]	Arylchloride
FP4_170	[F][c]	Arylfluoride
FP4_171	[Br][c]	Arylbromide
FP4_172	[I][c]	Aryliodide
FP4_173	[SX2H][c]	Arylthiol
FP4_174	"[c]=[NX2;$([H1]),$([H0][#6;!$([C]=[N,S,O])])]"	Iminoarene
FP4_175	[c]=[OX1]	Oxoarene
FP4_176	[c]=[SX1]	Thioarene
FP4_177	[nX3H1+0]	Hetero_N_basic_H
FP4_178	[nX3H0+0]	Hetero_N_basic_no_H
FP4_179	"[nX2,nX3+]"	Hetero_N_nonbasic
FP4_180	[o]	Hetero_O
FP4_181	[sX2]	Hetero_S
FP4_182	[a;!c]	Heteroaromatic
FP4_183	"[NX2](=[OX1])[O;$([X2]),$([X1-])]"	Nitrite
FP4_184	[SX2][NX2]=[OX1]	Thionitrite
FP4_185	"[$([NX3](=[OX1])(=[OX1])[O;$([X2]),$([X1-])]),$([NX3+]([OX1-])(=[OX1])[O;$([X2]),$([X1-])])]"	Nitrate
FP4_186	"[$([NX3](=O)=O),$([NX3+](=O)[O-])][!#8]"	Nitro
FP4_187	[NX2](=[OX1])[!#7;!#8]	Nitroso
FP4_188	"[NX1]~[NX2]~[NX2,NX1]"	Azide
FP4_189	[CX3](=[OX1])[NX2]~[NX2]~[NX1]	Acylazide
FP4_190	"[$([#6]=[NX2+]=[NX1-]),$([#6-]-[NX2+]#[NX1])]"	Diazo
FP4_191	[#6][NX2+]#[NX1]	Diazonium
FP4_192	[#7;!$(N*=O)][NX2]=[OX1]	Nitrosamine
FP4_193	[NX2](=[OX1])N-*=O	Nitrosamide
FP4_194	"[$([#7+][OX1-]),$([#7v5]=[OX1]);!$([#7](~[O])~[O]);!$([#7]=[#7])]"	N-Oxide
FP4_195	"[NX3;$([H2]),$([H1][#6]),$([H0]([#6])[#6]);!$(NC=[O,N,S])][NX3;$([H2]),$([H1][#6]),$([H0]([#6])[#6]);!$(NC=[O,N,S])]"	Hydrazine
FP4_196	"[NX3;$([H2]),$([H1][#6]),$([H0]([#6])[#6]);!$(NC=[O,N,S])][NX2]=[#6]"	Hydrazone
FP4_197	"[NX3;$([H2]),$([H1][#6]),$([H0]([#6])[#6]);!$(NC=[O,N,S])][OX2;$([H1]),$(O[#6;!$(C=[N,O,S])])]"	Hydroxylamine
FP4_198	"[$([SX4](=[OX1])(=[OX1])([#6])[#6]),$([SX4+2]([OX1-])([OX1-])([#6])[#6])]"	Sulfon
FP4_199	"[$([SX3](=[OX1])([#6])[#6]),$([SX3+]([OX1-])([#6])[#6])]"	Sulfoxide
FP4_200	"[S+;!$([S]~[!#6]);!$([S]*~[#7,#8,#15,#16])]"	Sulfonium
FP4_201	"[SX4](=[OX1])(=[OX1])([$([OX2H]),$([OX1-])])[$([OX2H]),$([OX1-])]"	Sulfuric_acid
FP4_202	"[SX4](=[OX1])(=[OX1])([$([OX2H]),$([OX1-])])[OX2][#6;!$(C=[O,N,S])]"	Sulfuric_monoester
FP4_203	"[SX4](=[OX1])(=[OX1])([OX2][#6;!$(C=[O,N,S])])[OX2][#6;!$(C=[O,N,S])]"	Sulfuric_diester
FP4_204	"[SX4](=[OX1])(=[OX1])([#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])])[$([OX2H]),$([OX1-])]"	Sulfuric_monoamide
FP4_205	"[SX4](=[OX1])(=[OX1])([#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Sulfuric_diamide
FP4_206	"[SX4](=[OX1])(=[OX1])([#7X3][#6;!$(C=[O,N,S])])[OX2][#6;!$(C=[O,N,S])]"	Sulfuric_esteramide
FP4_207	[SX4D4](=[!#6])(=[!#6])([!#6])[!#6]	Sulfuric_derivative
FP4_208	"[SX4;$([H1]),$([H0][#6])](=[OX1])(=[OX1])[$([OX2H]),$([OX1-])]"	Sulfonic_acid
FP4_209	"[SX4;$([H1]),$([H0][#6])](=[OX1])(=[OX1])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Sulfonamide
FP4_210	"[SX4;$([H1]),$([H0][#6])](=[OX1])(=[OX1])[OX2][#6;!$(C=[O,N,S])]"	Sulfonic_ester
FP4_211	"[SX4;$([H1]),$([H0][#6])](=[OX1])(=[OX1])[FX1,ClX1,BrX1,IX1]"	Sulfonic_halide
FP4_212	"[SX4;$([H1]),$([H0][#6])](=[!#6])(=[!#6])[!#6]"	Sulfonic_derivative
FP4_213	"[SX3;$([H1]),$([H0][#6])](=[OX1])[$([OX2H]),$([OX1-])]"	Sulfinic_acid
FP4_214	"[SX3;$([H1]),$([H0][#6])](=[OX1])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Sulfinic_amide
FP4_215	"[SX3;$([H1]),$([H0][#6])](=[OX1])[OX2][#6;!$(C=[O,N,S])]"	Sulfinic_ester
FP4_216	"[SX3;$([H1]),$([H0][#6])](=[OX1])[FX1,ClX1,BrX1,IX1]"	Sulfinic_halide
FP4_217	"[SX3;$([H1]),$([H0][#6])](=[!#6])[!#6]"	Sulfinic_derivative
FP4_218	"[SX2;$([H1]),$([H0][#6])][$([OX2H]),$([OX1-])]"	Sulfenic_acid
FP4_219	"[SX2;$([H1]),$([H0][#6])][#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Sulfenic_amide
FP4_220	"[SX2;$([H1]),$([H0][#6])][OX2][#6;!$(C=[O,N,S])]"	Sulfenic_ester
FP4_221	"[SX2;$([H1]),$([H0][#6])][FX1,ClX1,BrX1,IX1]"	Sulfenic_halide
FP4_222	"[SX2;$([H1]),$([H0][#6])][!#6]"	Sulfenic_derivative
FP4_223	"[PX3;$([H3]),$([H2][#6]),$([H1]([#6])[#6]),$([H0]([#6])([#6])[#6])]"	Phosphine
FP4_224	"[PX4;$([H3]=[OX1]),$([H2](=[OX1])[#6]),$([H1](=[OX1])([#6])[#6]),$([H0](=[OX1])([#6])([#6])[#6])]"	Phosphine_oxide
FP4_225	"[P+;!$([P]~[!#6]);!$([P]*~[#7,#8,#15,#16])]"	Phosphonium
FP4_226	"[PX4;$([H3]=[CX3]),$([H2](=[CX3])[#6]),$([H1](=[CX3])([#6])[#6]),$([H0](=[CX3])([#6])([#6])[#6])]"	Phosphorylen
FP4_227	"[PX4;$([H1]),$([H0][#6])](=[OX1])([$([OX2H]),$([OX1-])])[$([OX2H]),$([OX1-])]"	Phosphonic_acid
FP4_228	"[PX4;$([H1]),$([H0][#6])](=[OX1])([$([OX2H]),$([OX1-])])[OX2][#6;!$(C=[O,N,S])]"	Phosphonic_monoester
FP4_229	"[PX4;$([H1]),$([H0][#6])](=[OX1])([OX2][#6;!$(C=[O,N,S])])[OX2][#6;!$(C=[O,N,S])]"	Phosphonic_diester
FP4_230	"[PX4;$([H1]),$([H0][#6])](=[OX1])([$([OX2H]),$([OX1-])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Phosphonic_monoamide
FP4_231	"[PX4;$([H1]),$([H0][#6])](=[OX1])([#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Phosphonic_diamide
FP4_232	"[PX4;$([H1]),$([H0][#6])](=[OX1])([OX2][#6;!$(C=[O,N,S])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Phosphonic_esteramide
FP4_233	"[PX4;$([H1]),$([H0][#6])](=[!#6])([!#6])[!#6]"	Phosphonic_acid_derivative
FP4_234	"[PX4D4](=[OX1])([$([OX2H]),$([OX1-])])([$([OX2H]),$([OX1-])])[$([OX2H]),$([OX1-])]"	Phosphoric_acid
FP4_235	"[PX4D4](=[OX1])([$([OX2H]),$([OX1-])])([$([OX2H]),$([OX1-])])[OX2][#6;!$(C=[O,N,S])]"	Phosphoric_monoester
FP4_236	"[PX4D4](=[OX1])([$([OX2H]),$([OX1-])])([OX2][#6;!$(C=[O,N,S])])[OX2][#6;!$(C=[O,N,S])]"	Phosphoric_diester
FP4_237	"[PX4D4](=[OX1])([OX2][#6;!$(C=[O,N,S])])([OX2][#6;!$(C=[O,N,S])])[OX2][#6;!$(C=[O,N,S])]"	Phosphoric_triester
FP4_238	"[PX4D4](=[OX1])([$([OX2H]),$([OX1-])])([$([OX2H]),$([OX1-])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Phosphoric_monoamide
FP4_239	"[PX4D4](=[OX1])([$([OX2H]),$([OX1-])])([#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Phosphoric_diamide
FP4_240	"[PX4D4](=[OX1])([#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])])([#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Phosphoric_triamide
FP4_241	"[PX4D4](=[OX1])([$([OX2H]),$([OX1-])])([OX2][#6;!$(C=[O,N,S])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Phosphoric_monoestermonoamide
FP4_242	"[PX4D4](=[OX1])([OX2][#6;!$(C=[O,N,S])])([OX2][#6;!$(C=[O,N,S])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Phosphoric_diestermonoamide
FP4_243	"[PX4D4](=[OX1])([OX2][#6;!$(C=[O,N,S])])([#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Phosphoric_monoesterdiamide
FP4_244	[PX4D4](=[!#6])([!#6])([!#6])[!#6]	Phosphoric_acid_derivative
FP4_245	"[PX4;$([H2]),$([H1][#6]),$([H0]([#6])[#6])](=[OX1])[$([OX2H]),$([OX1-])]"	Phosphinic_acid
FP4_246	"[PX4;$([H2]),$([H1][#6]),$([H0]([#6])[#6])](=[OX1])[OX2][#6;!$(C=[O,N,S])]"	Phosphinic_ester
FP4_247	"[PX4;$([H2]),$([H1][#6]),$([H0]([#6])[#6])](=[OX1])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Phosphinic_amide
FP4_248	"[PX4;$([H2]),$([H1][#6]),$([H0]([#6])[#6])](=[!#6])[!#6]"	Phosphinic_acid_derivative
FP4_249	"[PX3;$([H1]),$([H0][#6])]([$([OX2H]),$([OX1-])])[$([OX2H]),$([OX1-])]"	Phosphonous_acid
FP4_250	"[PX3;$([H1]),$([H0][#6])]([$([OX2H]),$([OX1-])])[OX2][#6;!$(C=[O,N,S])]"	Phosphonous_monoester
FP4_251	"[PX3;$([H1]),$([H0][#6])]([OX2][#6;!$(C=[O,N,S])])[OX2][#6;!$(C=[O,N,S])]"	Phosphonous_diester
FP4_252	"[PX3;$([H1]),$([H0][#6])]([$([OX2H]),$([OX1-])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Phosphonous_monoamide
FP4_253	"[PX3;$([H1]),$([H0][#6])]([#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Phosphonous_diamide
FP4_254	"[PX3;$([H1]),$([H0][#6])]([OX2][#6;!$(C=[O,N,S])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Phosphonous_esteramide
FP4_255	"[PX3;$([D2]),$([D3][#6])]([!#6])[!#6]"	Phosphonous_derivatives
FP4_256	"[PX3;$([H2]),$([H1][#6]),$([H0]([#6])[#6])][$([OX2H]),$([OX1-])]"	Phosphinous_acid
FP4_257	"[PX3;$([H2]),$([H1][#6]),$([H0]([#6])[#6])][OX2][#6;!$(C=[O,N,S])]"	Phosphinous_ester
FP4_258	"[PX3;$([H2]),$([H1][#6]),$([H0]([#6])[#6])][#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	Phosphinous_amide
FP4_259	"[PX3;$([H2]),$([H1][#6]),$([H0]([#6])[#6])][!#6]"	Phosphinous_derivatives
FP4_260	[SiX4]([#6])([#6])([#6])[#6]	Quart_silane
FP4_261	"[SiX4;$([H1]([#6])([#6])[#6]),$([H2]([#6])[#6]),$([H3][#6]),$([H4])]"	Non-quart_silane
FP4_262	"[SiX4]([FX1,ClX1,BrX1,IX1])([#6])([#6])[#6]"	Silylmonohalide
FP4_263	[SiX4]([!#6])([#6])([#6])[#6]	Het_trialkylsilane
FP4_264	[SiX4]([!#6])([!#6])([#6])[#6]	Dihet_dialkylsilane
FP4_265	[SiX4]([!#6])([!#6])([!#6])[#6]	Trihet_alkylsilane
FP4_266	[SiX4]([!#6])([!#6])([!#6])[!#6]	Silicic_acid_derivative
FP4_267	[BX3]([#6])([#6])[#6]	Trialkylborane
FP4_268	[BX3]([!#6])([!#6])[!#6]	Boric_acid_derivatives
FP4_269	[BX3]([!#6])([!#6])[!#6]	Boronic_acid_derivative
FP4_270	"[BH1,BH2,BH3,BH4]"	Borohydride
FP4_271	[BX4]	Quaternary_boron
FP4_272	a	Aromatic
FP4_273	[!#6;!R0]	Heterocyclic
FP4_274	[OX2r3]1[#6r3][#6r3]1	Epoxide
FP4_275	[NX3H1r3]1[#6r3][#6r3]1	NH_aziridine
FP4_276	[D4R;$(*(@*)(@*)(@*)@*)]	Spiro
FP4_277	[R;$(*(@*)(@*)@*);!$([R2;$(*(@*)(@*)(@*)@*)])]@[R;$(*(@*)(@*)@*);!$([R2;$(*(@*)(@*)(@*)@*)])]	Annelated_rings
FP4_278	[R;$(*(@*)(@*)@*);!$([D4R;$(*(@*)(@*)(@*)@*)]);!$([R;$(*(@*)(@*)@*);!$([R2;$(*(@*)(@*)(@*)@*)])]@[R;$(*(@*)(@*)@*);!$([R2;$(*(@*)(@*)(@*)@*)])])]	Bridged_rings
FP4_279	"[OX2;$([r5]1@C@C@C(O)@C1),$([r6]1@C@C@C(O)@C(O)@C1)]"	Sugar_pattern_1
FP4_280	"[OX2;$([r5]1@C(!@[OX2,NX3,SX2,FX1,ClX1,BrX1,IX1])@C@C@C1),$([r6]1@C(!@[OX2,NX3,SX2,FX1,ClX1,BrX1,IX1])@C@C@C@C1)]"	Sugar_pattern_2
FP4_281	"[OX2;$([r5]1@C(!@[OX2,NX3,SX2,FX1,ClX1,BrX1,IX1])@C@C(O)@C1),$([r6]1@C(!@[OX2,NX3,SX2,FX1,ClX1,BrX1,IX1])@C@C(O)@C(O)@C1)]"	Sugar_pattern_combi
FP4_282	"[OX2;$([r5]1@C(!@[OX2H1])@C@C@C1),$([r6]1@C(!@[OX2H1])@C@C@C@C1)]"	Sugar_pattern_2_reducing
FP4_283	"[OX2;$([r5]1@[C@@](!@[OX2,NX3,SX2,FX1,ClX1,BrX1,IX1])@C@C@C1),$([r6]1@[C@@](!@[OX2,NX3,SX2,FX1,ClX1,BrX1,IX1])@C@C@C@C1)]"	Sugar_pattern_2_alpha
FP4_284	"[OX2;$([r5]1@[C@](!@[OX2,NX3,SX2,FX1,ClX1,BrX1,IX1])@C@C@C1),$([r6]1@[C@](!@[OX2,NX3,SX2,FX1,ClX1,BrX1,IX1])@C@C@C@C1)]"	Sugar_pattern_2_beta
FP4_285	"*=*[*]=,#,:[*]"	Conjugated_double_bond
FP4_286	"*#*[*]=,#,:[*]"	Conjugated_tripple_bond
FP4_287	*/[D2]=[D2]\*	Cis_double_bond
FP4_288	*/[D2]=[D2]/*	Trans_double_bond
FP4_289	"[$(*=O),$([#16,#14,#5]),$([#7]([#6]=[OX1]))][#8X2][$(*=O),$([#16,#14,#5]),$([#7]([#6]=[OX1]))]"	Mixed_anhydrides
FP4_290	"[FX1,ClX1,BrX1,IX1][!#6]"	Halogen_on_hetero
FP4_291	"[F,Cl,Br,I;!$([X1]);!$([X0-])]"	Halogen_multi_subst
FP4_292	"[FX1][CX4;!$([H0][Cl,Br,I]);!$([F][C]([F])([F])[F])]([FX1])([FX1])"	Trifluoromethyl
FP4_293	"[#6]~[#7,#8,#16]"	C_ONS_bond
FP4_294	[!+0]	Charged
FP4_295	"[-1,-2,-3,-4,-5,-6,-7]"	Anion
FP4_296	"[+1,+2,+3,+4,+5,+6,+7]"	Kation
FP4_297	"([-1,-2,-3,-4,-5,-6,-7]).([+1,+2,+3,+4,+5,+6,+7])"	Salt
FP4_298	"[$([#7X2,OX1,SX1]=*[!H0;!$([a;!n])]),$([#7X3,OX2,SX2;!H0]*=*),$([#7X3,OX2,SX2;!H0]*:n)]"	"1,3-Tautomerizable"
FP4_299	"[$([#7X2,OX1,SX1]=,:**=,:*[!H0;!$([a;!n])]),$([#7X3,OX2,SX2;!H0]*=**=*),$([#7X3,OX2,SX2;!H0]*=,:**:n)]"	"1,5-Tautomerizable"
FP4_300	[!$(*#*)&!D1]-!@[!$(*#*)&!D1]	Rotatable_bond
FP4_301	"[CX3]=[CX3][$([CX3]=[O,N,S]),$(C#[N]),$([S,P]=[OX1]),$([NX3]=O),$([NX3+](=O)[O-])]"	Michael_acceptor
FP4_302	[CX3](=[OX1])[NX2]=[NX2][CX3](=[OX1])	Dicarbodiazene
FP4_303	"[$([CX4;!$([H0]);!$(C[!#6;!$([P,S]=O);!$(N(~O)~O)])][$([CX3]=[O,N,S]),$(C#[N]),$([S,P]=[OX1]),$([NX3]=O),$([NX3+](=O)[O-]);!$(*[S,O,N;H1,H2]);!$([*+0][S,O;X1-])]),$([CX4;!$([H0])]1[CX3]=[CX3][CX3]=[CX3]1)]"	CH-acidic
FP4_304	"[CX4;!$([H0]);!$(C[!#6;!$([P,S]=O);!$(N(~O)~O)])]([$([CX3]=[O,N,S]),$(C#[N]),$([S,P]=[OX1]),$([NX3]=O),$([NX3+](=O)[O-]);!$(*[S,O,N;H1,H2]);!$([*+0][S,O;X1-])])[$([CX3]=[O,N,S]),$(C#[N]),$([S,P]=[OX1]),$([NX3]=O),$([NX3+](=O)[O-]);!$(*[S,O,N;H1,H2]);!$([*+0][S,O;X1-])]"	CH-acidic_strong
FP4_305	"[$([*@](~*)(~*)(*)*),$([*@H](*)(*)*),$([*@](~*)(*)*),$([*@H](~*)~*)]"	Chiral_center_specified
MACCS_1	"[#103,#104]"	ISOTOPE Not complete
MACCS_2	"[Ge,As,Se,Sn,Sb,Te,Tl,Pb,Bi]"	"Group IVa,Va,VIa Periods 4-6 (Ge...)  *NOTE* spec wrong"
MACCS_3	"[Ac,Th,Pa,U,Np,Pu,Am,Cm,Bk,Cf,Es,Fm,Md,No,Lr]"	actinide
MACCS_4	"[Sc,Ti,Y,Zr,Hf]"	"Group IIIB,IVB (Sc...)  *NOTE* spec wrong"
MACCS_5	"[La,Ce,Pr,Nd,Pm,Sm,Eu,Gd,Tb,Dy,Ho,Er,Tm,Yb,Lu]"	Lanthanide
MACCS_6	"[V,Cr,Mn,Nb,Mo,Tc,Ta,W,Re]"	"Group VB,VIB,VIIB (V...) *NOTE* spec wrong"
MACCS_7	[!C;!c;!#1]1~*~*~*~*1	QAAA@1
MACCS_8	"[Fe,Co,Ni,Ru,Rh,Pd,Os,Ir,Pt]"	Group VIII (Fe...)
MACCS_9	"[Be,Mg,Ca,Sr,Ba,Ra]"	Group IIa (Alkaline earth)
MACCS_10	*1~*~*~*~*1	4M Ring 
MACCS_11	"[Cu,Zn,Ag,Cd,Au,Hg]"	"Group IB,IIB (Cu..)"
MACCS_12	"[O,o]~[N,n](~[C,c])~[C,c]"	ON(C)C
MACCS_13	"[S,s]-[S,s]"	S-S
MACCS_14	"[O,o]~[C,c](~[O,o])~[O,o]"	OC(O)O
MACCS_15	[!C;!c;!#1]1~*~*~*1	QAA@1
MACCS_16	"[C,c]#[C,c]"	CTC
MACCS_17	"[B,Al,Ga,In,Tl]"	Group IIIA (B...) *NOTE* spec wrong
MACCS_18	*1~*~*~*~*~*~*~*1	7M Ring
MACCS_19	[Si]	Si
MACCS_20	"[C,c]=[C,c](~[!C;!c;!#1])~[!C;!c;!#1]"	C=C(Q)Q
MACCS_21	*1~*~*~*1	3M Ring
MACCS_22	"[N,n]~[C,c](~[O,o])~[O,o]"	NC(O)O
MACCS_23	"[N,n]-[O,o]"	N-O
MACCS_24	"[N,n]~[C,c](~[N,n])~[N,n]"	NC(N)N
MACCS_25	"[C,c]=;@[C,c](@*)@*"	C$=C($A)$A
MACCS_26	[I]	I
MACCS_27	[!C;!c;!#1]~[CH2]~[!C;!c;!#1]	QCH2Q
MACCS_28		P
MACCS_29	"[C,c]~[!C;!c;!#1](~[C,c])(~[C,c])~*"	CQ(C)(C)A
MACCS_30	"[!C;!c;!#1]~[F,Cl,Br,I]"	QX
MACCS_31	"[C,c]~[S,s]~[N,n]"	CSN
MACCS_32	"[N,n]~[S,s]"	NS
MACCS_33	[CH2]=*	CH2=A
MACCS_34	"[Li,Na,K,Rb,Cs,Fr]"	Group IA (Alkali Metal)
MACCS_35	"[$(S@*),$(s@*)]"	S Heterocycle
MACCS_36	"[N,n]~[C,c](~[O,o])~[N,n]"	NC(O)N
MACCS_37	"[N,n]~[C,c](~[C,c])~[N,n]"	NC(C)N
MACCS_38	"[O,o]~[S,s](~[O,o])~[O,o]"	OS(O)O
MACCS_39	"[S,s]-[O,o]"	S-O
MACCS_40	"[C,c]#[N,n]"	CTN
MACCS_41	F	F
MACCS_42	"[!C;!c;!#1;H,H2,H3,H4]~*~[!C;!c;!#1;H,H2,H3,H4]"	QHAQH FIX: possibly incomplete
MACCS_43	?	OTHER
MACCS_44	"[C,c]=[C,c]~[N,n]"	C=CN
MACCS_45	Br	BR
MACCS_46	"[S,s]~*~[N,n]"	SAN
MACCS_47	"[O,o]~[!C;!c;!#1](~[O,o])(~[O,o])~*"	OQ(O)O
MACCS_48	"[-,-2,-3,-4,+,+2,+3,+4]"	CHARGE  FIX: possibly incomplete
MACCS_49	"[C,c]=[C,c](~[C,c])~[C,c]"	C=C(C)C
MACCS_50	"[C,c]~[S,s]~[O,o]"	CSO
MACCS_51	"[N,n]~[N,n]"	NN
MACCS_52	[!#6;!#1;!H0]~*~*~*~[!#6;!#1;!H0]	QHAAAQH FIX: possibly incomplete
MACCS_53	[!#6;!#1;!H0]~*~*~[!#6;!#1;!H0]	QHAAQH FIX: possibly incomplete
MACCS_54	"[O,o]~[S,s]~[O,o]"	OSO
MACCS_55	"[O,o]~[N,n](~[O,o])~[C,c]"	ON(O)C
MACCS_56	"[$(O@*),$(o@*)]"	O Heterocycle
MACCS_57	"[!C;!c;!#1]~[S,s]~[!C;!c;!#1]"	QSQ
MACCS_58	"[S,s]!:*:*"	Snot%A%A
MACCS_59	"[S,s]=[O,o]"	S=O
MACCS_60	"*~[S,s](~*)~*"	AS(A)A
MACCS_61	*@*!@*@*	A$!A$A
MACCS_62	"[N,n]=[O,o]"	N=O
MACCS_63	"*@*!@[S,s]"	A$A!S
MACCS_64	"[C,c]:[N,n]"	C%N
MACCS_65	"[C,c]~[C,c](~[C,c])(~[C,c])~*"	CC(C)(C)A
MACCS_66	"[!C;!c;!#1]~[S,s]"	QS
MACCS_67	[!#6;!#1;!H0]~[!#6;!#1;!H0]	QHQH FIX: possibly incomplete
MACCS_68	[!C;!c;!#1]~[!#6;!#1;!H0]	QQH FIX: possibly incomplete
MACCS_69	"[!C;!c;!#1]~[N,n]~[!C;!c;!#1]"	QNQ
MACCS_70	"[N,n]~[O,o]"	NO
MACCS_71	"[O,o]~*~*~[O,o]"	OAAO
MACCS_72	"[S,s]=*"	S=A
MACCS_73	[CH3]~*~[CH3]	CH3ACH3
MACCS_74	"*!@[N,n]@*"	A!N$A
MACCS_75	"[C,c]=[C,c](~*)~*"	C=C(A)A
MACCS_76	"[N,n]~*~[N,n]"	NAN
MACCS_77	"[C,c]=[N,n]"	C=N
MACCS_78	"[N,n]~*~*~[N,n]"	NAAN
MACCS_79	"[N,n]~*~*~*~[N,n]"	NAAAN
MACCS_80	"[S,s]~*(~*)~*"	SA(A)A
MACCS_81	*~[CH2]~[!#6;!#1;!H0]	ACH2QH
MACCS_82	[!C;!c;!#1]1~*~*~*~*~*1	QAAAA@1
MACCS_83	[NH2]	NH2
MACCS_84	"[C,c]~[N,n](~[C,c])~[C,c]"	CN(C)C
MACCS_85	[CH2][!C;!c;!#1][CH2]	CH2QCH2
MACCS_86	"[F,Cl,Br,I]!@*@*"	X!A$A
MACCS_87	"[S,s]"	S
MACCS_88	"[O,o]~*~*~*~[O,o]"	OAAAO
MACCS_89	[!#6;!#1;!H0]~*~*~[CH2]~*	QHAACH2A
MACCS_90	[!#6;!#1;!H0]~*~*~*~[CH2]~*	QHAAACH2A
MACCS_91	"[O,o]~[C,c](~[N,n])~[C,c]"	OC(N)C
MACCS_92	[!C;!c;!#1]~[CH3]	QCH3
MACCS_93	"[!C;!c;!#1]~[N,n]"	QN
MACCS_94	"[N,n]~*~*~[O,o]"	NAAO
MACCS_95	*1~*~*~*~*~*1	5 M ring
MACCS_96	"[N,n]~*~*~*~[O,o]"	NAAAO
MACCS_97	[!C;!c;!#1]1~*~*~*~*~*~*1	QAAAAA@1
MACCS_98	"[C,c]=[C,c]"	C=C
MACCS_99	"*~[CH2]~[N,n]"	ACH2N
MACCS_100	"[r8,r9,r10,r11,r12]"	8M Ring or larger FIX: 
MACCS_101	"[!C;!c;!#1]~[O,o]"	QO
MACCS_102	Cl	CL
MACCS_103	[!#6;!#1;!H0]~*~[CH2]~*	QHACH2A
MACCS_104	[!C;!c;!#1]@*(@*)@*	A$A($A)$A
MACCS_105	[!C;!c;!#1]~*(~[!C;!c;!#1])~[!C;!c;!#1]	QA(Q)Q
MACCS_106	"[F,Cl,Br,I]~*(~*)~*"	XA(A)A
MACCS_107	[CH3]~*~*~*~[CH2]~*	CH3AAACH2A
MACCS_108	"*~[CH2]~[O,o]"	ACH2O
MACCS_109	"[N,n]~[C,c]~[O,o]"	NCO
MACCS_110	"[N,n]~*~[CH2]~*"	NACH2A
MACCS_111	*~*(~*)(~*)~*	AA(A)(A)A
MACCS_112	"[O,o]!:*:*"	Onot%A%A
MACCS_113	[CH3]~[CH2]~*	CH3CH2A
MACCS_114	[CH3]~*~[CH2]~*	CH3ACH2A
MACCS_115	[CH3]~*~*~[CH2]~*	CH3AACH2A
MACCS_116	"[N,n]~*~[O,o]"	NAO
MACCS_117	*~[CH2]~[CH2]~*	ACH2CH2A > 1
MACCS_118	"[N,n]=*"	N=A
MACCS_119	[!C;!c;R]	Heterocyclic atom > 1
MACCS_120	"[$(N@*),$(n@*)]"	N Heterocycle
MACCS_121	"*~[N,n](~*)~*"	AN(A)A
MACCS_122	"[O,o]~[C,c]~[O,o]"	OCO
MACCS_123	[!C;!c;!#1]~[!C;!c;!#1]	QQ
MACCS_124	?	Aromatic Ring > 1
MACCS_125	"*!@[O,o]!@*"	A!O!A
MACCS_126	"*@*!@[O,o]"	A$A!O > 1
MACCS_127	*~[CH2]~*~*~*~[CH2]~*	ACH2AAACH2A
MACCS_128	*~[CH2]~*~*~[CH2]~*	ACH2AACH2A
MACCS_129	[!C;!c;!#1]~[!C;!c;!#1]	QQ > 1 (&...)
MACCS_130	[!#6;!#1;!H0]	QH > 1
MACCS_131	"[O,o]~*~[CH2]~*"	OACH2A
MACCS_132	"*@*!:[N,n]"	A$A!N
MACCS_133	"[F,Cl,Br,I]"	X (HALOGEN)
MACCS_134	"[N,n]!:*:*"	Nnot%A%A
MACCS_135	"[O,o]=*"	O=A>1 FIX: maybe not right key
MACCS_136	[!C;!c;R]	Heterocycle
MACCS_137	[!C;!c;!#1]~[CH2]~*	QCH2A>1 (&...)
MACCS_138	"[OH,OH2,OH3]"	OH
MACCS_139	"[O,o]"	O > 3
MACCS_140	[CH3]	CH3 > 2
MACCS_141	"[N,n]"	N > 1
MACCS_142	"*@*!@[O,o]"	A$A!O
MACCS_143	*!:*:*!:*	Anot%A%Anot%A
MACCS_144	*1~*~*~*~*~*~*1	6M ring > 1
MACCS_145	"[O,o]"	O > 2
MACCS_146	*~[CH2]~[CH2]~*	ACH2CH2A
MACCS_147	*~[!C;!c;!#1](~*)~*	AQ(A)A
MACCS_148	[CH3]	CH3 > 1
MACCS_149	*!@*@*!@*	A!A$A!A
MACCS_150	[N!H0]	NH
MACCS_151	"[O,o]~[C,c](~[C,c])~[C,c]"	OC(C)C
MACCS_152	[!C;!c;!#1]~[CH2]~*	QCH2A
MACCS_153	"[C,c]=[O,o]"	C=O
MACCS_154	*!@[CH2]!@*	A!CH2!A
MACCS_155	"[N,n]~*(~*)~*"	NA(A)A
MACCS_156	"[C,c]-[O,o]"	C-O
MACCS_157	"[C,c]-[N,n]"	C-N
MACCS_158	"[O,o]"	O>1
MACCS_159	[CH3]	CH3
MACCS_160	"[N,n]"	N
MACCS_161	a	Aromatic
MACCS_162	*1~*~*~*~*~*~*1	6M Ring
MACCS_163	"[O,o]"	O
MACCS_164	[R]	Ring
PADEL_EStateFP1	[LiD1]-*	PADEL_EStateFP1
PADEL_EStateFP2	[BeD2](-*)-*	PADEL_EStateFP2
PADEL_EStateFP3	[BeD4](-*)(-*)(-*)-*	PADEL_EStateFP3
PADEL_EStateFP4	[BD2H](-*)-*	PADEL_EStateFP4
PADEL_EStateFP5	[BD3](-*)(-*)-*	PADEL_EStateFP5
PADEL_EStateFP6	[BD4](-*)(-*)(-*)-*	PADEL_EStateFP6
PADEL_EStateFP7	[CD1H3]-*	PADEL_EStateFP7
PADEL_EStateFP8	[CD1H2]=*	PADEL_EStateFP8
PADEL_EStateFP9	[CD2H2](-*)-*	PADEL_EStateFP9
PADEL_EStateFP10	[CD1H]#*	PADEL_EStateFP10
PADEL_EStateFP11	[CD2H](=*)-*	PADEL_EStateFP11
PADEL_EStateFP12	"[C,c;D2H](:*):*"	PADEL_EStateFP12
PADEL_EStateFP13	[CD3H](-*)(-*)-*	PADEL_EStateFP13
PADEL_EStateFP14	[CD2H0](=*)=*	PADEL_EStateFP14
PADEL_EStateFP15	[CD2H0](#*)-*	PADEL_EStateFP15
PADEL_EStateFP16	[CD3H0](=*)(-*)-*	PADEL_EStateFP16
PADEL_EStateFP17	"[C,c;D3H0](:*)(:*)-*"	PADEL_EStateFP17
PADEL_EStateFP18	"[C,c;D3H0](:*)(:*):*"	PADEL_EStateFP18
PADEL_EStateFP19	[CD4H0](-*)(-*)(-*)-*	PADEL_EStateFP19
PADEL_EStateFP20	[ND1H3]-*	PADEL_EStateFP20
PADEL_EStateFP21	[ND1H2]-*	PADEL_EStateFP21
PADEL_EStateFP22	[ND2H2](-*)-*	PADEL_EStateFP22
PADEL_EStateFP23	[ND1H]=*	PADEL_EStateFP23
PADEL_EStateFP24	[ND2H](-*)-*	PADEL_EStateFP24
PADEL_EStateFP25	"[N,nD2H](:*):*"	PADEL_EStateFP25
PADEL_EStateFP26	[ND1H0]#*	PADEL_EStateFP26
PADEL_EStateFP27	[ND3H](-*)(-*)-*	PADEL_EStateFP27
PADEL_EStateFP28	[ND2H0](=*)-*	PADEL_EStateFP28
PADEL_EStateFP29	"[N,nD2H0](:*):*"	PADEL_EStateFP29
PADEL_EStateFP30	[ND3H0](-*)(-*)-*	PADEL_EStateFP30
PADEL_EStateFP31	"[ND3H0](~[OD1H0])(~[OD1H0])-,:*"	PADEL_EStateFP31
PADEL_EStateFP32	"[N,nD3H0](:*)(:*)-,:*"	PADEL_EStateFP32
PADEL_EStateFP33	[ND4H0](-*)(-*)(-*)-*	PADEL_EStateFP33
PADEL_EStateFP34	[OD1H]-*	PADEL_EStateFP34
PADEL_EStateFP35	[OD1H0]=*	PADEL_EStateFP35
PADEL_EStateFP36	[OD2H0](-*)-*	PADEL_EStateFP36
PADEL_EStateFP37	"[O,oD2H0](:*):*"	PADEL_EStateFP37
PADEL_EStateFP38	[FD1]-*	PADEL_EStateFP38
PADEL_EStateFP39	[SiD1H3]-*	PADEL_EStateFP39
PADEL_EStateFP40	[SiD2H2](-*)-*	PADEL_EStateFP40
PADEL_EStateFP41	[SiD3H1](-*)(-*)-*	PADEL_EStateFP41
PADEL_EStateFP42	[SiD4H0](-*)(-*)(-*)-*	PADEL_EStateFP42
PADEL_EStateFP43	[PD1H2]-*	PADEL_EStateFP43
PADEL_EStateFP44	[PD2H1](-*)-*	PADEL_EStateFP44
PADEL_EStateFP45	[PD3H0](-*)(-*)-*	PADEL_EStateFP45
PADEL_EStateFP46	[PD4H0](=*)(-*)(-*)-*	PADEL_EStateFP46
PADEL_EStateFP47	[PD5H0](-*)(-*)(-*)(-*)-*	PADEL_EStateFP47
PADEL_EStateFP48	[SD1H1]-*	PADEL_EStateFP48
PADEL_EStateFP49	[SD1H0]=*	PADEL_EStateFP49
PADEL_EStateFP50	[SD2H0](-*)-*	PADEL_EStateFP50
PADEL_EStateFP51	"[S,sD2H0](:*):*"	PADEL_EStateFP51
PADEL_EStateFP52	[SD3H0](=*)(-*)-*	PADEL_EStateFP52
PADEL_EStateFP53	[SD4H0](~[OD1H0])(~[OD1H0])(-*)-*	PADEL_EStateFP53
PADEL_EStateFP54	[ClD1]-*	PADEL_EStateFP54
PADEL_EStateFP55	[GeD1H3](-*)	PADEL_EStateFP55
PADEL_EStateFP56	[GeD2H2](-*)-*	PADEL_EStateFP56
PADEL_EStateFP57	[GeD3H1](-*)(-*)-*	PADEL_EStateFP57
PADEL_EStateFP58	[GeD4H0](-*)(-*)(-*)-*	PADEL_EStateFP58
PADEL_EStateFP59	[AsD1H2]-*	PADEL_EStateFP59
PADEL_EStateFP60	[AsD2H1](-*)-*	PADEL_EStateFP60
PADEL_EStateFP61	[AsD3H0](-*)(-*)-*	PADEL_EStateFP61
PADEL_EStateFP62	[AsD4H0](=*)(-*)(-*)-*	PADEL_EStateFP62
PADEL_EStateFP63	[AsD5H0](-*)(-*)(-*)(-*)-*	PADEL_EStateFP63
PADEL_EStateFP64	[SeD1H1]-*	PADEL_EStateFP64
PADEL_EStateFP65	[SeD1H0]=*	PADEL_EStateFP65
PADEL_EStateFP66	[SeD2H0](-*)-*	PADEL_EStateFP66
PADEL_EStateFP67	[SeD2H0](:*):*	PADEL_EStateFP67
PADEL_EStateFP68	[SeD3H0](=*)(-*)-*	PADEL_EStateFP68
PADEL_EStateFP69	[SeD4H0](=*)(=*)(-*)-*	PADEL_EStateFP69
PADEL_EStateFP70	[BrD1]-*	PADEL_EStateFP70
PADEL_EStateFP71	[SnD1H3]-*	PADEL_EStateFP71
PADEL_EStateFP72	[SnD2H2](-*)-*	PADEL_EStateFP72
PADEL_EStateFP73	[SnD3H1](-*)(-*)-*	PADEL_EStateFP73
PADEL_EStateFP74	[SnD4H0](-*)(-*)(-*)-*	PADEL_EStateFP74
PADEL_EStateFP75	[ID1]-*	PADEL_EStateFP75
PADEL_EStateFP76	[PbD1H3]-*	PADEL_EStateFP76
PADEL_EStateFP77	[PbD2H2](-*)-*	PADEL_EStateFP77
PADEL_EStateFP78	[PbD3H1](-*)(-*)-*	PADEL_EStateFP78
PADEL_EStateFP79	[PbD4H0](-*)(-*)(-*)-*.	PADEL_EStateFP79
PADEL_SubFP1	[CX4H3][#6]	PADEL_SubFP1
PADEL_SubFP2	[CX4H2]([#6])[#6]	PADEL_SubFP2
PADEL_SubFP3	[CX4H1]([#6])([#6])[#6]	PADEL_SubFP3
PADEL_SubFP4	[CX4]([#6])([#6])([#6])[#6]	PADEL_SubFP4
PADEL_SubFP5	"[CX3;$([H2]),$([H1][#6]),$(C([#6])[#6])]=[CX3;$([H2]),$([H1][#6]),$(C([#6])[#6])]"	PADEL_SubFP5
PADEL_SubFP6	[CX2]#[CX2]	PADEL_SubFP6
PADEL_SubFP7	[CX3]=[CX2]=[CX3]	PADEL_SubFP7
PADEL_SubFP8	[ClX1][CX4]	PADEL_SubFP8
PADEL_SubFP9	[FX1][CX4]	PADEL_SubFP9
PADEL_SubFP10	[BrX1][CX4]	PADEL_SubFP10
PADEL_SubFP11	[IX1][CX4]	PADEL_SubFP11
PADEL_SubFP12	"[OX2H][CX4;!$(C([OX2H])[O,S,#7,#15])]"	PADEL_SubFP12
PADEL_SubFP13	"[OX2H][CX4H2;!$(C([OX2H])[O,S,#7,#15])]"	PADEL_SubFP13
PADEL_SubFP14	"[OX2H][CX4H;!$(C([OX2H])[O,S,#7,#15])]"	PADEL_SubFP14
PADEL_SubFP15	"[OX2H][CX4D4;!$(C([OX2H])[O,S,#7,#15])]"	PADEL_SubFP15
PADEL_SubFP16	"[OX2]([CX4;!$(C([OX2])[O,S,#7,#15,F,Cl,Br,I])])[CX4;!$(C([OX2])[O,S,#7,#15])]"	PADEL_SubFP16
PADEL_SubFP17	"[SX2]([CX4;!$(C([OX2])[O,S,#7,#15,F,Cl,Br,I])])[CX4;!$(C([OX2])[O,S,#7,#15])]"	PADEL_SubFP17
PADEL_SubFP18	"[OX2](c)[CX4;!$(C([OX2])[O,S,#7,#15,F,Cl,Br,I])]"	PADEL_SubFP18
PADEL_SubFP19	[c][OX2][c]	PADEL_SubFP19
PADEL_SubFP20	"[SX2](c)[CX4;!$(C([OX2])[O,S,#7,#15,F,Cl,Br,I])]"	PADEL_SubFP20
PADEL_SubFP21	[c][SX2][c]	PADEL_SubFP21
PADEL_SubFP22	"[O+;!$([O]~[!#6]);!$([S]*~[#7,#8,#15,#16])]"	PADEL_SubFP22
PADEL_SubFP23	"[NX3+0,NX4+;!$([N]~[!#6]);!$([N]*~[#7,#8,#15,#16])]"	PADEL_SubFP23
PADEL_SubFP24	"[NX3H2+0,NX4H3+;!$([N][!C]);!$([N]*~[#7,#8,#15,#16])]"	PADEL_SubFP24
PADEL_SubFP25	"[NX3H1+0,NX4H2+;!$([N][!C]);!$([N]*~[#7,#8,#15,#16])]"	PADEL_SubFP25
PADEL_SubFP26	"[NX3H0+0,NX4H1+;!$([N][!C]);!$([N]*~[#7,#8,#15,#16])]"	PADEL_SubFP26
PADEL_SubFP27	"[NX4H0+;!$([N][!C]);!$([N]*~[#7,#8,#15,#16])]"	PADEL_SubFP27
PADEL_SubFP28	"[NX3H2+0,NX4H3+]c"	PADEL_SubFP28
PADEL_SubFP29	"[NX3H1+0,NX4H2+;!$([N][!c]);!$([N]*~[#7,#8,#15,#16])]"	PADEL_SubFP29
PADEL_SubFP30	"[NX3H0+0,NX4H1+;!$([N][!c]);!$([N]*~[#7,#8,#15,#16])]"	PADEL_SubFP30
PADEL_SubFP31	"[NX4H0+;!$([N][!c]);!$([N]*~[#7,#8,#15,#16])]"	PADEL_SubFP31
PADEL_SubFP32	"[NX3H1+0,NX4H2+;$([N]([c])[C]);!$([N]*~[#7,#8,#15,#16])]"	PADEL_SubFP32
PADEL_SubFP33	"[NX3H0+0,NX4H1+;$([N]([c])([C])[#6]);!$([N]*~[#7,#8,#15,#16])]"	PADEL_SubFP33
PADEL_SubFP34	"[NX4H0+;$([N]([c])([C])[#6][#6]);!$([N]*~[#7,#8,#15,#16])]"	PADEL_SubFP34
PADEL_SubFP35	"[N+;!$([N]~[!#6]);!$(N=*);!$([N]*~[#7,#8,#15,#16])]"	PADEL_SubFP35
PADEL_SubFP36	"[SX2H][CX4;!$(C([SX2H])~[O,S,#7,#15])]"	PADEL_SubFP36
PADEL_SubFP37	"[SX2]([CX4;!$(C([SX2])[O,S,#7,#15,F,Cl,Br,I])])[CX4;!$(C([SX2])[O,S,#7,#15])]"	PADEL_SubFP37
PADEL_SubFP38	"[SX2](c)[CX4;!$(C([SX2])[O,S,#7,#15])]"	PADEL_SubFP38
PADEL_SubFP39	[SX2D2][SX2D2]	PADEL_SubFP39
PADEL_SubFP40	"[OX2H][CX4;!$(C([OX2H])[O,S,#7,#15,F,Cl,Br,I])][CX4;!$(C([N])[O,S,#7,#15])][NX3;!$(NC=[O,S,N])]"	PADEL_SubFP40
PADEL_SubFP41	"[OX2H][CX4;!$(C([OX2H])[O,S,#7,#15])][CX4;!$(C([OX2H])[O,S,#7,#15])][OX2H]"	PADEL_SubFP41
PADEL_SubFP42	"[OX2H][CX4;!$(C([OX2H])([OX2H])[O,S,#7,#15])][OX2H]"	PADEL_SubFP42
PADEL_SubFP43	[OX2H][OX2]	PADEL_SubFP43
PADEL_SubFP44	[OX2D2][OX2D2]	PADEL_SubFP44
PADEL_SubFP45	"[LiX1][#6,#14]"	PADEL_SubFP45
PADEL_SubFP46	"[MgX2][#6,#14]"	PADEL_SubFP46
PADEL_SubFP47	[!#1;!#5;!#6;!#7;!#8;!#9;!#14;!#15;!#16;!#17;!#33;!#34;!#35;!#52;!#53;!#85]~[#6;!-]	PADEL_SubFP47
PADEL_SubFP48	"[$([CX3H][#6]),$([CX3H2])]=[OX1]"	PADEL_SubFP48
PADEL_SubFP49	[#6][CX3](=[OX1])[#6]	PADEL_SubFP49
PADEL_SubFP50	"[$([CX3H][#6]),$([CX3H2])]=[SX1]"	PADEL_SubFP50
PADEL_SubFP51	[#6][CX3](=[SX1])[#6]	PADEL_SubFP51
PADEL_SubFP52	"[NX2;$([N][#6]),$([NH]);!$([N][CX3]=[#7,#8,#15,#16])]=[CX3;$([CH2]),$([CH][#6]),$([C]([#6])[#6])]"	PADEL_SubFP52
PADEL_SubFP53	"[NX3+;!$([N][!#6]);!$([N][CX3]=[#7,#8,#15,#16])]"	PADEL_SubFP53
PADEL_SubFP54	"[NX2](=[CX3;$([CH2]),$([CH][#6]),$([C]([#6])[#6])])[OX2H]"	PADEL_SubFP54
PADEL_SubFP55	"[NX2](=[CX3;$([CH2]),$([CH][#6]),$([C]([#6])[#6])])[OX2][#6;!$(C=[#7,#8])]"	PADEL_SubFP55
PADEL_SubFP56	"[OX2]([#6;!$(C=[O,S,N])])[CX4;!$(C(O)(O)[!#6])][OX2][#6;!$(C=[O,S,N])]"	PADEL_SubFP56
PADEL_SubFP57	"[OX2H][CX4;!$(C(O)(O)[!#6])][OX2][#6;!$(C=[O,S,N])]"	PADEL_SubFP57
PADEL_SubFP58	"[NX3v3;!$(NC=[#7,#8,#15,#16])]([#6])[CX4;!$(C(N)(N)[!#6])][NX3v3;!$(NC=[#7,#8,#15,#16])][#6]"	PADEL_SubFP58
PADEL_SubFP59	"[NX3v3;!$(NC=[#7,#8,#15,#16])]([#6])[CX4;!$(C(N)(N)[!#6])][OX2H]"	PADEL_SubFP59
PADEL_SubFP60	"[SX2]([#6;!$(C=[O,S,N])])[CX4;!$(C(S)(S)[!#6])][SX2][#6;!$(C=[O,S,N])]"	PADEL_SubFP60
PADEL_SubFP61	"[SX2]([#6;!$(C=[O,S,N])])[CX4;!$(C(S)(S)[!#6])][OX2H]"	PADEL_SubFP61
PADEL_SubFP62	"[NX3v3,SX2,OX2;!$(*C=[#7,#8,#15,#16])][CX4;!$(C([N,S,O])([N,S,O])[!#6])][FX1,ClX1,BrX1,IX1]"	PADEL_SubFP62
PADEL_SubFP63	"[NX3v3,SX2,OX2;!$(*C=[#7,#8,#15,#16])][CX4;!$(C([N,S,O])([N,S,O])[!#6])][FX1,ClX1,BrX1,IX1,NX3v3,SX2,OX2;!$(*C=[#7,#8,#15,#16])]"	PADEL_SubFP63
PADEL_SubFP64	"[NX3v3,SX2,OX2;$(**=[#7,#8,#15,#16])][CX4;!$(C([N,S,O])([N,S,O])[!#6])][FX1,ClX1,BrX1,IX1]"	PADEL_SubFP64
PADEL_SubFP65	"[NX3v3,SX2,OX2;$(**=[#7,#8,#15,#16])][CX4;!$(C([N,S,O])([N,S,O])[!#6])][NX3v3,SX2,OX2;!$(*C=[#7,#8,#15,#16])]"	PADEL_SubFP65
PADEL_SubFP66	"[NX3v3,SX2,OX2;$(**=[#7,#8,#15,#16])][CX4;!$(C([N,S,O])([N,S,O])[!#6])][FX1,ClX1,BrX1,IX1,NX3v3,SX2,OX2;!$(*C=[#7,#8,#15,#16])]"	PADEL_SubFP66
PADEL_SubFP67	"[NX1]#[CX2][CX4;$([CH2]),$([CH]([CX2])[#6]),$(C([CX2])([#6])[#6])][OX2H]"	PADEL_SubFP67
PADEL_SubFP68	[ClX1][CX3]=[CX3]	PADEL_SubFP68
PADEL_SubFP69	[FX1][CX3]=[CX3]	PADEL_SubFP69
PADEL_SubFP70	[BrX1][CX3]=[CX3]	PADEL_SubFP70
PADEL_SubFP71	[IX1][CX3]=[CX3]	PADEL_SubFP71
PADEL_SubFP72	"[OX2H][CX3;$([H1]),$(C[#6])]=[CX3]"	PADEL_SubFP72
PADEL_SubFP73	"[OX2H][CX3;$([H1]),$(C[#6])]=[CX3;$([H1]),$(C[#6])][OX2H]"	PADEL_SubFP73
PADEL_SubFP74	"[OX2]([#6;!$(C=[N,O,S])])[CX3;$([H0][#6]),$([H1])]=[CX3]"	PADEL_SubFP74
PADEL_SubFP75	"[OX2]([CX3]=[OX1])[#6X3;$([#6][#6]),$([H1])]=[#6X3;!$(C[OX2H])]"	PADEL_SubFP75
PADEL_SubFP76	"[NX3;$([NH2][CX3]),$([NH1]([CX3])[#6]),$([N]([CX3])([#6])[#6]);!$([N]*=[#7,#8,#15,#16])][CX3;$([CH]),$([C][#6])]=[CX3]"	PADEL_SubFP76
PADEL_SubFP77	"[SX2H][CX3;$([H1]),$(C[#6])]=[CX3]"	PADEL_SubFP77
PADEL_SubFP78	"[SX2]([#6;!$(C=[N,O,S])])[CX3;$(C[#6]),$([CH])]=[CX3]"	PADEL_SubFP78
PADEL_SubFP79	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[ClX1]"	PADEL_SubFP79
PADEL_SubFP80	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[FX1]"	PADEL_SubFP80
PADEL_SubFP81	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[BrX1]"	PADEL_SubFP81
PADEL_SubFP82	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[IX1]"	PADEL_SubFP82
PADEL_SubFP83	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[FX1,ClX1,BrX1,IX1]"	PADEL_SubFP83
PADEL_SubFP84	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[$([OX2H]),$([OX1-])]"	PADEL_SubFP84
PADEL_SubFP85	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP85
PADEL_SubFP86	"[#6][#6X3R](=[OX1])[#8X2][#6;!$(C=[O,N,S])]"	PADEL_SubFP86
PADEL_SubFP87	"[CX3;$([H0][#6]),$([H1])](=[OX1])[#8X2][CX3;$([H0][#6]),$([H1])](=[OX1])"	PADEL_SubFP87
PADEL_SubFP88	"[$([#6X3H0][#6]),$([#6X3H])](=[!#6])[!#6]"	PADEL_SubFP88
PADEL_SubFP89	"[CX3;!R;$([C][#6]),$([CH]);$([C](=[OX1])[$([SX2H]),$([SX1-])]),$([C](=[SX1])[$([OX2H]),$([OX1-])])]"	PADEL_SubFP89
PADEL_SubFP90	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[SX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP90
PADEL_SubFP91	"[#6][#6X3R](=[OX1])[#16X2][#6;!$(C=[O,N,S])]"	PADEL_SubFP91
PADEL_SubFP92	"[CX3;$([H0][#6]),$([H1])](=[SX1])[OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP92
PADEL_SubFP93	"[#6][#6X3R](=[SX1])[#8X2][#6;!$(C=[O,N,S])]"	PADEL_SubFP93
PADEL_SubFP94	"[CX3;$([H0][#6]),$([H1])](=[SX1])[FX1,ClX1,BrX1,IX1]"	PADEL_SubFP94
PADEL_SubFP95	"[CX3;!R;$([C][#6]),$([CH]);$([C](=[SX1])[SX2H])]"	PADEL_SubFP95
PADEL_SubFP96	"[CX3;!R;$([C][#6]),$([CH]);$([C](=[SX1])[SX2][#6;!$(C=[O,N,S])])]"	PADEL_SubFP96
PADEL_SubFP97	"[#6][#6X3R](=[SX1])[#16X2][#6;!$(C=[O,N,S])]"	PADEL_SubFP97
PADEL_SubFP98	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP98
PADEL_SubFP99	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[NX3H2]"	PADEL_SubFP99
PADEL_SubFP100	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[#7X3H1][#6;!$(C=[O,N,S])]"	PADEL_SubFP100
PADEL_SubFP101	"[CX3;$([R0][#6]),$([H1R0])](=[OX1])[#7X3H0]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])]"	PADEL_SubFP101
PADEL_SubFP102	"[#6R][#6X3R](=[OX1])[#7X3;$([H1][#6;!$(C=[O,N,S])]),$([H0]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP102
PADEL_SubFP103	"[#6X3;$([H0][#6]),$([H1])](=[OX1])[#7X3H0]([#6])[#6X3;$([H0][#6]),$([H1])](=[OX1])"	PADEL_SubFP103
PADEL_SubFP104	"[#6X3;$([H0][#6]),$([H1])](=[OX1])[#7X3H0]([!#6])[#6X3;$([H0][#6]),$([H1])](=[OX1])"	PADEL_SubFP104
PADEL_SubFP105	"[#6X3;$([H0][#6]),$([H1])](=[OX1])[#7X3H1][#6X3;$([H0][#6]),$([H1])](=[OX1])"	PADEL_SubFP105
PADEL_SubFP106	"[$([CX3;!R][#6]),$([CX3H;!R])](=[SX1])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP106
PADEL_SubFP107	"[#6R][#6X3R](=[SX1])[#7X3;$([H1][#6;!$(C=[O,N,S])]),$([H0]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP107
PADEL_SubFP108	"[#6X3;$([H0][#6]),$([H1])](=[OX1])[#8X2][#7X2]=,:[#6X3;$([H0]([#6])[#6]),$([H1][#6]),$([H2])]"	PADEL_SubFP108
PADEL_SubFP109	"[NX3;!$(NC=[O,S])][CX3;$([CH]),$([C][#6])]=[NX2;!$(NC=[O,S])]"	PADEL_SubFP109
PADEL_SubFP110	"[CX3;$([H0][#6]),$([H1])](=[OX1])[#7X3;$([H1]),$([H0][#6;!$(C=[O,N,S])])][$([OX2H]),$([OX1-])]"	PADEL_SubFP110
PADEL_SubFP111	"[CX3;$([H0][#6]),$([H1])](=[OX1])[#7X3;$([H1]),$([H0][#6;!$(C=[O,N,S])])][OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP111
PADEL_SubFP112	"[CX3R0;$([H0][#6]),$([H1])](=[NX2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[$([OX2H]),$([OX1-])]"	PADEL_SubFP112
PADEL_SubFP113	"[#6R][#6X3R](=,:[#7X2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[$([OX2H]),$([OX1-])]"	PADEL_SubFP113
PADEL_SubFP114	"[CX3R0;$([H0][#6]),$([H1])](=[NX2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP114
PADEL_SubFP115	"[#6R][#6X3R](=,:[#7X2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP115
PADEL_SubFP116	"[CX3R0;$([H0][#6]),$([H1])](=[NX2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[$([SX2H]),$([SX1-])]"	PADEL_SubFP116
PADEL_SubFP117	"[#6R][#6X3R](=,:[#7X2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[$([SX2H]),$([SX1-])]"	PADEL_SubFP117
PADEL_SubFP118	"[CX3R0;$([H0][#6]),$([H1])](=[NX2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[SX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP118
PADEL_SubFP119	"[#6R][#6X3R](=,:[#7X2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[SX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP119
PADEL_SubFP120	"[#7X3v3;!$(N([#6X3]=[#7X2])C=[O,S])][CX3R0;$([H1]),$([H0][#6])]=[NX2v3;!$(N(=[#6X3][#7X3])C=[O,S])]"	PADEL_SubFP120
PADEL_SubFP121	"[#6][#6X3R;$([H0](=[NX2;!$(N(=[#6X3][#7X3])C=[O,S])])[#7X3;!$(N([#6X3]=[#7X2])C=[O,S])]),$([H0](-[NX3;!$(N([#6X3]=[#7X2])C=[O,S])])=,:[#7X2;!$(N(=[#6X3][#7X3])C=[O,S])])]"	PADEL_SubFP121
PADEL_SubFP122	"[CX3R0;$([H0][#6]),$([H1])](=[NX2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[FX1,ClX1,BrX1,IX1]"	PADEL_SubFP122
PADEL_SubFP123	"[#6R][#6X3R](=,:[#7X2;$([H1]),$([H0][#6;!$(C=[O,N,S])])])[FX1,ClX1,BrX1,IX1]"	PADEL_SubFP123
PADEL_SubFP124	"[$([$([#6X3][#6]),$([#6X3H])](=[#7X2v3])[#7X3v3][#7X3v3]),$([$([#6X3][#6]),$([#6X3H])]([#7X3v3])=[#7X2v3][#7X3v3])]"	PADEL_SubFP124
PADEL_SubFP125	"[NX3,NX4+;!$([N]~[!#6]);!$([N]*~[#7,#8,#15,#16])][C][CX3](=[OX1])[OX2H,OX1-]"	PADEL_SubFP125
PADEL_SubFP126	"[OX2H][C][CX3](=[OX1])[OX2H,OX1-]"	PADEL_SubFP126
PADEL_SubFP127	"[NX3;$([N][CX3](=[OX1])[C][NX3,NX4+])][C][CX3](=[OX1])[NX3;$([N][C][CX3](=[OX1])[NX3,OX2,OX1-])]"	PADEL_SubFP127
PADEL_SubFP128	"[NX3;$([N][CX3](=[OX1])[C][NX3,NX4+])][C][CX3](=[OX1])[OX2H,OX1-]"	PADEL_SubFP128
PADEL_SubFP129	"[NX3,NX4+;!$([N]~[!#6]);!$([N]*~[#7,#8,#15,#16])][C][CX3](=[OX1])[NX3;$([N][C][CX3](=[OX1])[NX3,OX2,OX1-])]"	PADEL_SubFP129
PADEL_SubFP130	"[#6][OX2][CX4;$(C[#6]),$([CH])]([OX2][#6])[OX2][#6]"	PADEL_SubFP130
PADEL_SubFP131	[CX3]=[CX2]=[OX1]	PADEL_SubFP131
PADEL_SubFP132	"[#7X2,#8X3,#16X2;$(*[#6,#14])][#6X3]([#7X2,#8X3,#16X2;$(*[#6,#14])])=[#6X3]"	PADEL_SubFP132
PADEL_SubFP133	[NX1]#[CX2]	PADEL_SubFP133
PADEL_SubFP134	[CX1-]#[NX2+]	PADEL_SubFP134
PADEL_SubFP135	"[#6X3](=[OX1])[#6X3]=,:[#6X3][#7,#8,#16,F,Cl,Br,I]"	PADEL_SubFP135
PADEL_SubFP136	"[#6X3](=[OX1])[#6X3]=,:[#6X3][$([OX2H]),$([OX1-])]"	PADEL_SubFP136
PADEL_SubFP137	"[#6X3](=[OX1])[#6X3]=,:[#6X3][#6;!$(C=[O,N,S])]"	PADEL_SubFP137
PADEL_SubFP138	"[#6X3](=[OX1])[#6X3]=,:[#6X3][#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP138
PADEL_SubFP139	"[#6X3](=[OX1])[#6X3]=,:[#6X3][FX1,ClX1,BrX1,IX1]"	PADEL_SubFP139
PADEL_SubFP140	"[#6;!$(C=[O,N,S])][#8X2][#6X3](=[OX1])[#8X2][#6;!$(C=[O,N,S])]"	PADEL_SubFP140
PADEL_SubFP141	"[#6;!$(C=[O,N,S])][OX2;!R][CX3](=[OX1])[OX2][FX1,ClX1,BrX1,IX1]"	PADEL_SubFP141
PADEL_SubFP142	"[#6;!$(C=[O,N,S])][OX2;!R][CX3](=[OX1])[$([OX2H]),$([OX1-])]"	PADEL_SubFP142
PADEL_SubFP143	[!#6][#6X3](=[!#6])[!#6]	PADEL_SubFP143
PADEL_SubFP144	"[#6;!$(C=[O,N,S])][#8X2][#6X3](=[SX1])[#8X2][#6;!$(C=[O,N,S])]"	PADEL_SubFP144
PADEL_SubFP145	"[#6;!$(C=[O,N,S])][OX2;!R][CX3](=[SX1])[OX2][FX1,ClX1,BrX1,IX1]"	PADEL_SubFP145
PADEL_SubFP146	"[#6;!$(C=[O,N,S])][OX2;!R][CX3](=[SX1])[$([OX2H]),$([OX1-])]"	PADEL_SubFP146
PADEL_SubFP147	[#7X3;!$([#7][!#6])][#6X3](=[OX1])[#7X3;!$([#7][!#6])]	PADEL_SubFP147
PADEL_SubFP148	[#7X3;!$([#7][!#6])][#6X3](=[SX1])[#7X3;!$([#7][!#6])]	PADEL_SubFP148
PADEL_SubFP149	"[#7X2;!$([#7][!#6])]=,:[#6X3]([#8X2&!$([#8][!#6]),OX1-])[#7X3;!$([#7][!#6])]"	PADEL_SubFP149
PADEL_SubFP150	"[#7X2;!$([#7][!#6])]=,:[#6X3]([#16X2&!$([#16][!#6]),SX1-])[#7X3;!$([#7][!#6])]"	PADEL_SubFP150
PADEL_SubFP151	"[N;v3X3,v4X4+][CX3](=[N;v3X2,v4X3+])[N;v3X3,v4X4+]"	PADEL_SubFP151
PADEL_SubFP152	"[NX3]C(=[OX1])[O;X2H,X1-]"	PADEL_SubFP152
PADEL_SubFP153	[#7X3][#6](=[OX1])[#8X2][#6]	PADEL_SubFP153
PADEL_SubFP154	[#7X3][#6](=[OX1])[#7X3][#6](=[OX1])[#7X3]	PADEL_SubFP154
PADEL_SubFP155	[#7X3][#7X3][#6X3]([#7X3;!$([#7][#7])])=[OX1]	PADEL_SubFP155
PADEL_SubFP156	[#7X3][#7X3][#6X3]([#7X3][#7X3])=[OX1]	PADEL_SubFP156
PADEL_SubFP157	[#7X2](=[#6])[#7X3][#6X3]([#7X3;!$([#7][#7])])=[OX1]	PADEL_SubFP157
PADEL_SubFP158	[#7X2](=[#6])[#7X3][#6X3]([#7X3][#7X3])=[OX1]	PADEL_SubFP158
PADEL_SubFP159	[#7X3][#7X3][#6X3]([#7X3;!$([#7][#7])])=[SX1]	PADEL_SubFP159
PADEL_SubFP160	[#7X3][#7X3][#6X3]([#7X3][#7X3])=[SX1]	PADEL_SubFP160
PADEL_SubFP161	[#7X2](=[#6])[#7X3][#6X3]([#7X3;!$([#7][#7])])=[SX1]	PADEL_SubFP161
PADEL_SubFP162	[#7X2](=[#6])[#7X3][#6X3]([#7X3][#7X3])=[SX1]	PADEL_SubFP162
PADEL_SubFP163	[NX2]=[CX2]=[OX1]	PADEL_SubFP163
PADEL_SubFP164	[OX2][CX2]#[NX1]	PADEL_SubFP164
PADEL_SubFP165	[NX2]=[CX2]=[SX1]	PADEL_SubFP165
PADEL_SubFP166	[SX2][CX2]#[NX1]	PADEL_SubFP166
PADEL_SubFP167	[NX2]=[CX2]=[NX2]	PADEL_SubFP167
PADEL_SubFP168	"[CX4H0]([O,S,#7])([O,S,#7])([O,S,#7])[O,S,#7,F,Cl,Br,I]"	PADEL_SubFP168
PADEL_SubFP169	[OX2H][c]	PADEL_SubFP169
PADEL_SubFP170	[OX2H][c][c][OX2H]	PADEL_SubFP170
PADEL_SubFP171	[Cl][c]	PADEL_SubFP171
PADEL_SubFP172	[F][c]	PADEL_SubFP172
PADEL_SubFP173	[Br][c]	PADEL_SubFP173
PADEL_SubFP174	[I][c]	PADEL_SubFP174
PADEL_SubFP175	[SX2H][c]	PADEL_SubFP175
PADEL_SubFP176	"[c]=[NX2;$([H1]),$([H0][#6;!$([C]=[N,S,O])])]"	PADEL_SubFP176
PADEL_SubFP177	[c]=[OX1]	PADEL_SubFP177
PADEL_SubFP178	[c]=[SX1]	PADEL_SubFP178
PADEL_SubFP179	[nX3H1+0]	PADEL_SubFP179
PADEL_SubFP180	[nX3H0+0]	PADEL_SubFP180
PADEL_SubFP181	"[nX2,nX3+]"	PADEL_SubFP181
PADEL_SubFP182	[o]	PADEL_SubFP182
PADEL_SubFP183	[sX2]	PADEL_SubFP183
PADEL_SubFP184	[a;!c]	PADEL_SubFP184
PADEL_SubFP185	"[NX2](=[OX1])[O;$([X2]),$([X1-])]"	PADEL_SubFP185
PADEL_SubFP186	[SX2][NX2]=[OX1]	PADEL_SubFP186
PADEL_SubFP187	"[$([NX3](=[OX1])(=[OX1])[O;$([X2]),$([X1-])]),$([NX3+]([OX1-])(=[OX1])[O;$([X2]),$([X1-])])]"	PADEL_SubFP187
PADEL_SubFP188	"[$([NX3](=O)=O),$([NX3+](=O)[O-])][!#8]"	PADEL_SubFP188
PADEL_SubFP189	[NX2](=[OX1])[!#7;!#8]	PADEL_SubFP189
PADEL_SubFP190	"[NX1]~[NX2]~[NX2,NX1]"	PADEL_SubFP190
PADEL_SubFP191	[CX3](=[OX1])[NX2]~[NX2]~[NX1]	PADEL_SubFP191
PADEL_SubFP192	"[$([#6]=[NX2+]=[NX1-]),$([#6-]-[NX2+]#[NX1])]"	PADEL_SubFP192
PADEL_SubFP193	[#6][NX2+]#[NX1]	PADEL_SubFP193
PADEL_SubFP194	[#7;!$(N*=O)][NX2]=[OX1]	PADEL_SubFP194
PADEL_SubFP195	[NX2](=[OX1])N-*=O	PADEL_SubFP195
PADEL_SubFP196	"[$([#7+][OX1-]),$([#7v5]=[OX1]);!$([#7](~[O])~[O]);!$([#7]=[#7])]"	PADEL_SubFP196
PADEL_SubFP197	"[NX3;$([H2]),$([H1][#6]),$([H0]([#6])[#6]);!$(NC=[O,N,S])][NX3;$([H2]),$([H1][#6]),$([H0]([#6])[#6]);!$(NC=[O,N,S])]"	PADEL_SubFP197
PADEL_SubFP198	"[NX3;$([H2]),$([H1][#6]),$([H0]([#6])[#6]);!$(NC=[O,N,S])][NX2]=[#6]"	PADEL_SubFP198
PADEL_SubFP199	"[NX3;$([H2]),$([H1][#6]),$([H0]([#6])[#6]);!$(NC=[O,N,S])][OX2;$([H1]),$(O[#6;!$(C=[N,O,S])])]"	PADEL_SubFP199
PADEL_SubFP200	"[$([SX4](=[OX1])(=[OX1])([#6])[#6]),$([SX4+2]([OX1-])([OX1-])([#6])[#6])]"	PADEL_SubFP200
PADEL_SubFP201	"[$([SX3](=[OX1])([#6])[#6]),$([SX3+]([OX1-])([#6])[#6])]"	PADEL_SubFP201
PADEL_SubFP202	"[S+;!$([S]~[!#6]);!$([S]*~[#7,#8,#15,#16])]"	PADEL_SubFP202
PADEL_SubFP203	"[SX4](=[OX1])(=[OX1])([$([OX2H]),$([OX1-])])[$([OX2H]),$([OX1-])]"	PADEL_SubFP203
PADEL_SubFP204	"[SX4](=[OX1])(=[OX1])([$([OX2H]),$([OX1-])])[OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP204
PADEL_SubFP205	"[SX4](=[OX1])(=[OX1])([OX2][#6;!$(C=[O,N,S])])[OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP205
PADEL_SubFP206	"[SX4](=[OX1])(=[OX1])([#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])])[$([OX2H]),$([OX1-])]"	PADEL_SubFP206
PADEL_SubFP207	"[SX4](=[OX1])(=[OX1])([#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP207
PADEL_SubFP208	"[SX4](=[OX1])(=[OX1])([#7X3][#6;!$(C=[O,N,S])])[OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP208
PADEL_SubFP209	[SX4D4](=[!#6])(=[!#6])([!#6])[!#6]	PADEL_SubFP209
PADEL_SubFP210	"[SX4;$([H1]),$([H0][#6])](=[OX1])(=[OX1])[$([OX2H]),$([OX1-])]"	PADEL_SubFP210
PADEL_SubFP211	"[SX4;$([H1]),$([H0][#6])](=[OX1])(=[OX1])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP211
PADEL_SubFP212	"[SX4;$([H1]),$([H0][#6])](=[OX1])(=[OX1])[OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP212
PADEL_SubFP213	"[SX4;$([H1]),$([H0][#6])](=[OX1])(=[OX1])[FX1,ClX1,BrX1,IX1]"	PADEL_SubFP213
PADEL_SubFP214	"[SX4;$([H1]),$([H0][#6])](=[!#6])(=[!#6])[!#6]"	PADEL_SubFP214
PADEL_SubFP215	"[SX3;$([H1]),$([H0][#6])](=[OX1])[$([OX2H]),$([OX1-])]"	PADEL_SubFP215
PADEL_SubFP216	"[SX3;$([H1]),$([H0][#6])](=[OX1])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP216
PADEL_SubFP217	"[SX3;$([H1]),$([H0][#6])](=[OX1])[OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP217
PADEL_SubFP218	"[SX3;$([H1]),$([H0][#6])](=[OX1])[FX1,ClX1,BrX1,IX1]"	PADEL_SubFP218
PADEL_SubFP219	"[SX3;$([H1]),$([H0][#6])](=[!#6])[!#6]"	PADEL_SubFP219
PADEL_SubFP220	"[SX2;$([H1]),$([H0][#6])][$([OX2H]),$([OX1-])]"	PADEL_SubFP220
PADEL_SubFP221	"[SX2;$([H1]),$([H0][#6])][#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP221
PADEL_SubFP222	"[SX2;$([H1]),$([H0][#6])][OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP222
PADEL_SubFP223	"[SX2;$([H1]),$([H0][#6])][FX1,ClX1,BrX1,IX1]"	PADEL_SubFP223
PADEL_SubFP224	"[SX2;$([H1]),$([H0][#6])][!#6]"	PADEL_SubFP224
PADEL_SubFP225	"[PX3;$([H3]),$([H2][#6]),$([H1]([#6])[#6]),$([H0]([#6])([#6])[#6])]"	PADEL_SubFP225
PADEL_SubFP226	"[PX4;$([H3]=[OX1]),$([H2](=[OX1])[#6]),$([H1](=[OX1])([#6])[#6]),$([H0](=[OX1])([#6])([#6])[#6])]"	PADEL_SubFP226
PADEL_SubFP227	"[P+;!$([P]~[!#6]);!$([P]*~[#7,#8,#15,#16])]"	PADEL_SubFP227
PADEL_SubFP228	"[PX4;$([H3]=[CX3]),$([H2](=[CX3])[#6]),$([H1](=[CX3])([#6])[#6]),$([H0](=[CX3])([#6])([#6])[#6])]"	PADEL_SubFP228
PADEL_SubFP229	"[PX4;$([H1]),$([H0][#6])](=[OX1])([$([OX2H]),$([OX1-])])[$([OX2H]),$([OX1-])]"	PADEL_SubFP229
PADEL_SubFP230	"[PX4;$([H1]),$([H0][#6])](=[OX1])([$([OX2H]),$([OX1-])])[OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP230
PADEL_SubFP231	"[PX4;$([H1]),$([H0][#6])](=[OX1])([OX2][#6;!$(C=[O,N,S])])[OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP231
PADEL_SubFP232	"[PX4;$([H1]),$([H0][#6])](=[OX1])([$([OX2H]),$([OX1-])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP232
PADEL_SubFP233	"[PX4;$([H1]),$([H0][#6])](=[OX1])([#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP233
PADEL_SubFP234	"[PX4;$([H1]),$([H0][#6])](=[OX1])([OX2][#6;!$(C=[O,N,S])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP234
PADEL_SubFP235	"[PX4;$([H1]),$([H0][#6])](=[!#6])([!#6])[!#6]"	PADEL_SubFP235
PADEL_SubFP236	"[PX4D4](=[OX1])([$([OX2H]),$([OX1-])])([$([OX2H]),$([OX1-])])[$([OX2H]),$([OX1-])]"	PADEL_SubFP236
PADEL_SubFP237	"[PX4D4](=[OX1])([$([OX2H]),$([OX1-])])([$([OX2H]),$([OX1-])])[OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP237
PADEL_SubFP238	"[PX4D4](=[OX1])([$([OX2H]),$([OX1-])])([OX2][#6;!$(C=[O,N,S])])[OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP238
PADEL_SubFP239	"[PX4D4](=[OX1])([OX2][#6;!$(C=[O,N,S])])([OX2][#6;!$(C=[O,N,S])])[OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP239
PADEL_SubFP240	"[PX4D4](=[OX1])([$([OX2H]),$([OX1-])])([$([OX2H]),$([OX1-])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP240
PADEL_SubFP241	"[PX4D4](=[OX1])([$([OX2H]),$([OX1-])])([#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP241
PADEL_SubFP242	"[PX4D4](=[OX1])([#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])])([#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP242
PADEL_SubFP243	"[PX4D4](=[OX1])([$([OX2H]),$([OX1-])])([OX2][#6;!$(C=[O,N,S])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP243
PADEL_SubFP244	"[PX4D4](=[OX1])([OX2][#6;!$(C=[O,N,S])])([OX2][#6;!$(C=[O,N,S])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP244
PADEL_SubFP245	"[PX4D4](=[OX1])([OX2][#6;!$(C=[O,N,S])])([#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP245
PADEL_SubFP246	[PX4D4](=[!#6])([!#6])([!#6])[!#6]	PADEL_SubFP246
PADEL_SubFP247	"[PX4;$([H2]),$([H1][#6]),$([H0]([#6])[#6])](=[OX1])[$([OX2H]),$([OX1-])]"	PADEL_SubFP247
PADEL_SubFP248	"[PX4;$([H2]),$([H1][#6]),$([H0]([#6])[#6])](=[OX1])[OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP248
PADEL_SubFP249	"[PX4;$([H2]),$([H1][#6]),$([H0]([#6])[#6])](=[OX1])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP249
PADEL_SubFP250	"[PX4;$([H2]),$([H1][#6]),$([H0]([#6])[#6])](=[!#6])[!#6]"	PADEL_SubFP250
PADEL_SubFP251	"[PX3;$([H1]),$([H0][#6])]([$([OX2H]),$([OX1-])])[$([OX2H]),$([OX1-])]"	PADEL_SubFP251
PADEL_SubFP252	"[PX3;$([H1]),$([H0][#6])]([$([OX2H]),$([OX1-])])[OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP252
PADEL_SubFP253	"[PX3;$([H1]),$([H0][#6])]([OX2][#6;!$(C=[O,N,S])])[OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP253
PADEL_SubFP254	"[PX3;$([H1]),$([H0][#6])]([$([OX2H]),$([OX1-])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP254
PADEL_SubFP255	"[PX3;$([H1]),$([H0][#6])]([#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP255
PADEL_SubFP256	"[PX3;$([H1]),$([H0][#6])]([OX2][#6;!$(C=[O,N,S])])[#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP256
PADEL_SubFP257	"[PX3;$([D2]),$([D3][#6])]([!#6])[!#6]"	PADEL_SubFP257
PADEL_SubFP258	"[PX3;$([H2]),$([H1][#6]),$([H0]([#6])[#6])][$([OX2H]),$([OX1-])]"	PADEL_SubFP258
PADEL_SubFP259	"[PX3;$([H2]),$([H1][#6]),$([H0]([#6])[#6])][OX2][#6;!$(C=[O,N,S])]"	PADEL_SubFP259
PADEL_SubFP260	"[PX3;$([H2]),$([H1][#6]),$([H0]([#6])[#6])][#7X3;$([H2]),$([H1][#6;!$(C=[O,N,S])]),$([#7]([#6;!$(C=[O,N,S])])[#6;!$(C=[O,N,S])])]"	PADEL_SubFP260
PADEL_SubFP261	"[PX3;$([H2]),$([H1][#6]),$([H0]([#6])[#6])][!#6]"	PADEL_SubFP261
PADEL_SubFP262	[SiX4]([#6])([#6])([#6])[#6]	PADEL_SubFP262
PADEL_SubFP263	"[SiX4;$([H1]([#6])([#6])[#6]),$([H2]([#6])[#6]),$([H3][#6]),$([H4])]"	PADEL_SubFP263
PADEL_SubFP264	"[SiX4]([FX1,ClX1,BrX1,IX1])([#6])([#6])[#6]"	PADEL_SubFP264
PADEL_SubFP265	[SiX4]([!#6])([#6])([#6])[#6]	PADEL_SubFP265
PADEL_SubFP266	[SiX4]([!#6])([!#6])([#6])[#6]	PADEL_SubFP266
PADEL_SubFP267	[SiX4]([!#6])([!#6])([!#6])[#6]	PADEL_SubFP267
PADEL_SubFP268	[SiX4]([!#6])([!#6])([!#6])[!#6]	PADEL_SubFP268
PADEL_SubFP269	[BX3]([#6])([#6])[#6]	PADEL_SubFP269
PADEL_SubFP270	[BX3]([!#6])([!#6])[!#6]	PADEL_SubFP270
PADEL_SubFP271	[BX3]([!#6])([!#6])[!#6]	PADEL_SubFP271
PADEL_SubFP272	"[BH1,BH2,BH3,BH4]"	PADEL_SubFP272
PADEL_SubFP273	[BX4]	PADEL_SubFP273
PADEL_SubFP274	a	PADEL_SubFP274
PADEL_SubFP275	[!#6;!R0]	PADEL_SubFP275
PADEL_SubFP276	[OX2r3]1[#6r3][#6r3]1	PADEL_SubFP276
PADEL_SubFP277	[NX3H1r3]1[#6r3][#6r3]1	PADEL_SubFP277
PADEL_SubFP278	[D4R;$(*(@*)(@*)(@*)@*)]	PADEL_SubFP278
PADEL_SubFP279	[R;$(*(@*)(@*)@*);!$([R2;$(*(@*)(@*)(@*)@*)])]@[R;$(*(@*)(@*)@*);!$([R2;$(*(@*)(@*)(@*)@*)])]	PADEL_SubFP279
PADEL_SubFP280	[R;$(*(@*)(@*)@*);!$([D4R;$(*(@*)(@*)(@*)@*)]);!$([R;$(*(@*)(@*)@*);!$([R2;$(*(@*)(@*)(@*)@*)])]@[R;$(*(@*)(@*)@*);!$([R2;$(*(@*)(@*)(@*)@*)])])]	PADEL_SubFP280
PADEL_SubFP281	"[OX2;$([r5]1@C@C@C(O)@C1),$([r6]1@C@C@C(O)@C(O)@C1)]"	PADEL_SubFP281
PADEL_SubFP282	"[OX2;$([r5]1@C(!@[OX2,NX3,SX2,FX1,ClX1,BrX1,IX1])@C@C@C1),$([r6]1@C(!@[OX2,NX3,SX2,FX1,ClX1,BrX1,IX1])@C@C@C@C1)]"	PADEL_SubFP282
PADEL_SubFP283	"[OX2;$([r5]1@C(!@[OX2,NX3,SX2,FX1,ClX1,BrX1,IX1])@C@C(O)@C1),$([r6]1@C(!@[OX2,NX3,SX2,FX1,ClX1,BrX1,IX1])@C@C(O)@C(O)@C1)]"	PADEL_SubFP283
PADEL_SubFP284	"[OX2;$([r5]1@C(!@[OX2H1])@C@C@C1),$([r6]1@C(!@[OX2H1])@C@C@C@C1)]"	PADEL_SubFP284
PADEL_SubFP285	"[OX2;$([r5]1@[C@@](!@[OX2,NX3,SX2,FX1,ClX1,BrX1,IX1])@C@C@C1),$([r6]1@[C@@](!@[OX2,NX3,SX2,FX1,ClX1,BrX1,IX1])@C@C@C@C1)]"	PADEL_SubFP285
PADEL_SubFP286	"[OX2;$([r5]1@[C@](!@[OX2,NX3,SX2,FX1,ClX1,BrX1,IX1])@C@C@C1),$([r6]1@[C@](!@[OX2,NX3,SX2,FX1,ClX1,BrX1,IX1])@C@C@C@C1)]"	PADEL_SubFP286
PADEL_SubFP287	"*=*[*]=,#,:[*]"	PADEL_SubFP287
PADEL_SubFP288	"*#*[*]=,#,:[*]"	PADEL_SubFP288
PADEL_SubFP289	*&#47[D2]=[D2]/*	PADEL_SubFP289
PADEL_SubFP290	*&#47[D2]=[D2]/*	PADEL_SubFP290
PADEL_SubFP291	"[$(*=O),$([#16,#14,#5]),$([#7]([#6]=[OX1]))][#8X2][$(*=O),$([#16,#14,#5]),$([#7]([#6]=[OX1]))]"	PADEL_SubFP291
PADEL_SubFP292	"[FX1,ClX1,BrX1,IX1][!#6]"	PADEL_SubFP292
PADEL_SubFP293	"[F,Cl,Br,I;!$([X1]);!$([X0-])]"	PADEL_SubFP293
PADEL_SubFP294	"[FX1][CX4;!$([H0][Cl,Br,I]);!$([F][C]([F])([F])[F])]([FX1])([FX1])"	PADEL_SubFP294
PADEL_SubFP295	"[#6]~[#7,#8,#16]"	PADEL_SubFP295
PADEL_SubFP296	[!+0]	PADEL_SubFP296
PADEL_SubFP297	"[-1,-2,-3,-4,-5,-6,-7]"	PADEL_SubFP297
PADEL_SubFP298	"[+1,+2,+3,+4,+5,+6,+7]"	PADEL_SubFP298
PADEL_SubFP299	"([-1,-2,-3,-4,-5,-6,-7]).([+1,+2,+3,+4,+5,+6,+7])"	PADEL_SubFP299
PADEL_SubFP300	"[$([#7X2,OX1,SX1]=*[!H0;!$([a;!n])]),$([#7X3,OX2,SX2;!H0]*=*),$([#7X3,OX2,SX2;!H0]*:n)]"	PADEL_SubFP300
PADEL_SubFP301	"[$([#7X2,OX1,SX1]=,:**=,:*[!H0;!$([a;!n])]),$([#7X3,OX2,SX2;!H0]*=**=*),$([#7X3,OX2,SX2;!H0]*=,:**:n)]"	PADEL_SubFP301
PADEL_SubFP302	[!$(*#*)&!D1]-!@[!$(*#*)&!D1]	PADEL_SubFP302
PADEL_SubFP303	"[CX3]=[CX3][$([CX3]=[O,N,S]),$(C#[N]),$([S,P]=[OX1]),$([NX3]=O),$([NX3+](=O)[O-])]"	PADEL_SubFP303
PADEL_SubFP304	[CX3](=[OX1])[NX2]=[NX2][CX3](=[OX1])	PADEL_SubFP304
PADEL_SubFP305	"[$([CX4;!$([H0]);!$(C[!#6;!$([P,S]=O);!$(N(~O)~O)])][$([CX3]=[O,N,S]),$(C#[N]),$([S,P]=[OX1]),$([NX3]=O),$([NX3+](=O)[O-]);!$(*[S,O,N;H1,H2]);!$([*+0][S,O;X1-])]),$([CX4;!$([H0])]1[CX3]=[CX3][CX3]=[CX3]1)]"	PADEL_SubFP305
PADEL_SubFP306	"[CX4;!$([H0]);!$(C[!#6;!$([P,S]=O);!$(N(~O)~O)])]([$([CX3]=[O,N,S]),$(C#[N]),$([S,P]=[OX1]),$([NX3]=O),$([NX3+](=O)[O-]);!$(*[S,O,N;H1,H2]);!$([*+0][S,O;X1-])])[$([CX3]=[O,N,S]),$(C#[N]),$([S,P]=[OX1]),$([NX3]=O),$([NX3+](=O)[O-]);!$(*[S,O,N;H1,H2]);!$([*+0][S,O;X1-])]"	PADEL_SubFP306
PADEL_SubFP307	"[$([*@](~*)(~*)(*)*),$([*@H](*)(*)*),$([*@](~*)(*)*),$([*@H](~*)~*)]"	PADEL_SubFP307
PADEL_KR1	[!#1][CH]([!#1])[!#1]	PADEL_KR1
PADEL_KR2	[!#1][CH]([!#1])[CH]([!#1])[!#1]	PADEL_KR2
PADEL_KR3	[!#1][CH]([!#1])[CH]([!#1])C([CH3])([CH3])[CH3]	PADEL_KR3
PADEL_KR4	[!#1][CH]([!#1])[CH](C(=O)O[CH3])C(=O)O[CH3]	PADEL_KR4
PADEL_KR5	[!#1][CH]([!#1])[CH]1[CH2][CH]([CH]([!#1])[!#1])[CH]([CH]1C(=O)[!#1])C(=O)[OH]	PADEL_KR5
PADEL_KR6	[!#1][CH]([!#1])[CH2][CH]([CH]([CH2][CH]([!#1])[!#1])C(=O)[!#1])C(=O)[!#1]	PADEL_KR6
PADEL_KR7	[!#1][CH]([!#1])[CH2][CH2][CH3]	PADEL_KR7
PADEL_KR8	[!#1][CH]([!#1])[CH2][CH2]C([!#1])([!#1])[CH3]	PADEL_KR8
PADEL_KR9	[!#1][CH]([!#1])[CH2]C(=N[NH]C(=S)[NH2])[CH2][CH3]	PADEL_KR9
PADEL_KR10	[!#1][CH]([!#1])[CH2]C(=O)[!#1]	PADEL_KR10
PADEL_KR11	[!#1][CH]([!#1])[CH2]C(=O)[CH2][CH3]	PADEL_KR11
PADEL_KR12	[!#1][CH]([!#1])[CH2]C(=O)[CH3]	PADEL_KR12
PADEL_KR13	[!#1][CH]([!#1])[CH2]N([!#1])[CH2][CH]([!#1])[!#1]	PADEL_KR13
PADEL_KR14	[!#1][CH]([!#1])[CH3]	PADEL_KR14
PADEL_KR15	[!#1][CH]([!#1])[N+](=O)[O-]	PADEL_KR15
PADEL_KR16	[!#1][CH]([!#1])[NH]C(=O)[!#1]	PADEL_KR16
PADEL_KR17	[!#1][CH]([!#1])[OH]	PADEL_KR17
PADEL_KR18	[!#1][CH]([!#1])C([!#1])([!#1])[!#1]	PADEL_KR18
PADEL_KR19	[!#1][CH]([!#1])C([!#1])([CH3])[CH3]	PADEL_KR19
PADEL_KR20	[!#1][CH]([!#1])C(=O)[!#1]	PADEL_KR20
PADEL_KR21	[!#1][CH]([!#1])C(=O)[CH]([!#1])[!#1]	PADEL_KR21
PADEL_KR22	[!#1][CH]([!#1])C(=O)[CH2]C([CH3])([CH3])[CH2]C([!#1])([!#1])[!#1]	PADEL_KR22
PADEL_KR23	[!#1][CH]([!#1])C(=O)[CH3]	PADEL_KR23
PADEL_KR24	[!#1][CH]([!#1])C(=O)[NH][NH]C(=O)[CH2][CH2][CH2][CH2][CH2][CH2][CH3]	PADEL_KR24
PADEL_KR25	[!#1][CH]([!#1])C(=O)[OH]	PADEL_KR25
PADEL_KR26	[!#1][CH]([!#1])C(=O)c1[cH][cH][cH][cH][cH]1	PADEL_KR26
PADEL_KR27	[!#1][CH]([!#1])C(=O)c1[cH][cH]c([!#1])[cH][cH]1	PADEL_KR27
PADEL_KR28	[!#1][CH]([!#1])C(=O)c1[cH][cH]c(Cl)[cH][cH]1	PADEL_KR28
PADEL_KR29	[!#1][CH]([!#1])C(=O)c1c([CH3])[cH]c([CH3])[nH]c1=O	PADEL_KR29
PADEL_KR30	[!#1][CH]([!#1])C(=O)c1c([CH3])[nH]c2[cH][cH][cH][cH]c12	PADEL_KR30
PADEL_KR31	[!#1][CH]([!#1])C(=O)c1c([OH])[cH]c([CH3])oc1=O	PADEL_KR31
PADEL_KR32	[!#1][CH]([!#1])C(=O)O[CH2][CH2]N([CH2][CH3])[CH2][CH3]	PADEL_KR32
PADEL_KR33	[!#1][CH]([!#1])c1[cH][cH][cH][cH][cH]1	PADEL_KR33
PADEL_KR34	[!#1][CH]([!#1])c1[cH][cH][cH][cH]c1[!#1]	PADEL_KR34
PADEL_KR35	[!#1][CH]([!#1])c1[cH][cH][cH][cH]c1[N+](=O)[O-]	PADEL_KR35
PADEL_KR36	[!#1][CH]([!#1])c1[cH][cH][cH][cH]c1[OH]	PADEL_KR36
PADEL_KR37	[!#1][CH]([!#1])c1[cH][cH][cH][cH]c1Cl	PADEL_KR37
PADEL_KR38	[!#1][CH]([!#1])c1[cH][cH][cH][cH]c1F	PADEL_KR38
PADEL_KR39	[!#1][CH]([!#1])c1[cH][cH][cH][cH]c1N([!#1])c2[cH][cH][cH][cH]c2[CH]([!#1])[!#1]	PADEL_KR39
PADEL_KR40	[!#1][CH]([!#1])c1[cH][cH][cH]c([cH]1)[N+](=O)[O-]	PADEL_KR40
PADEL_KR41	[!#1][CH]([!#1])c1[cH][cH][cH]c(Br)[cH]1	PADEL_KR41
PADEL_KR42	[!#1][CH]([!#1])c1[cH][cH][cH]n[cH]1	PADEL_KR42
PADEL_KR43	[!#1][CH]([!#1])c1[cH][cH][cH]o1	PADEL_KR43
PADEL_KR44	[!#1][CH]([!#1])c1[cH][cH][cH]s1	PADEL_KR44
PADEL_KR45	[!#1][CH]([!#1])c1[cH][cH]c([!#1])[cH][cH]1	PADEL_KR45
PADEL_KR46	[!#1][CH]([!#1])c1[cH][cH]c([!#1])o1	PADEL_KR46
PADEL_KR47	[!#1][CH]([!#1])c1[cH][cH]c([cH][cH]1)[CH]([!#1])[!#1]	PADEL_KR47
PADEL_KR48	[!#1][CH]([!#1])c1[cH][cH]c([cH][cH]1)[N+](=O)[O-]	PADEL_KR48
PADEL_KR49	[!#1][CH]([!#1])c1[cH][cH]c([cH][cH]1)N([!#1])[CH3]	PADEL_KR49
PADEL_KR50	[!#1][CH]([!#1])c1[cH][cH]c([CH3])[cH]c1[CH3]	PADEL_KR50
PADEL_KR51	[!#1][CH]([!#1])c1[cH][cH]c([CH3])o1	PADEL_KR51
PADEL_KR52	[!#1][CH]([!#1])c1[cH][cH]c([OH])[cH][cH]1	PADEL_KR52
PADEL_KR53	[!#1][CH]([!#1])c1[cH][cH]c(Br)[cH][cH]1	PADEL_KR53
PADEL_KR54	[!#1][CH]([!#1])c1[cH][cH]c(Cl)[cH][cH]1	PADEL_KR54
PADEL_KR55	[!#1][CH]([!#1])c1[cH][cH]c(Cl)[cH]c1Cl	PADEL_KR55
PADEL_KR56	[!#1][CH]([!#1])c1[cH][cH]c(F)[cH][cH]1	PADEL_KR56
PADEL_KR57	[!#1][CH]([!#1])c1[cH][cH]c2O[CH2]Oc2[cH]1	PADEL_KR57
PADEL_KR58	[!#1][CH]([!#1])c1[cH][cH]n[cH][cH]1	PADEL_KR58
PADEL_KR59	[!#1][CH]([!#1])c1[cH][nH]c2[cH][cH][cH][cH]c12	PADEL_KR59
PADEL_KR60	[!#1][CH]([!#1])c1[cH]c([!#1])nn1[!#1]	PADEL_KR60
PADEL_KR61	[!#1][CH]([!#1])c1[cH]c([cH][cH]c1[OH])[N+](=O)[O-]	PADEL_KR61
PADEL_KR62	[!#1][CH]([!#1])c1[cH]c(Br)[cH]c(Br)c1[OH]	PADEL_KR62
PADEL_KR63	[!#1][CH]([!#1])C1=C([OH])[CH2]C([CH3])([CH3])[CH2]C1=O	PADEL_KR63
PADEL_KR64	[!#1][CH]([!#1])c1c([OH])[cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR64
PADEL_KR65	[!#1][CH]([!#1])c1c2[cH][cH][cH][cH]c2[cH]c3[cH][cH][cH][cH]c13	PADEL_KR65
PADEL_KR66	[!#1][CH]([!#1])c1sc2[cH][cH][cH][cH]c2[n+]1[CH2][CH2][CH2]S(=O)(=O)[OH]	PADEL_KR66
PADEL_KR67	[!#1][CH]([!#1])N([!#1])[CH3]	PADEL_KR67
PADEL_KR68	[!#1][CH]([!#1])N([!#1])c1[cH][cH][cH][cH][cH]1	PADEL_KR68
PADEL_KR69	[!#1][CH]([!#1])N([CH3])[CH3]	PADEL_KR69
PADEL_KR70	[!#1][CH]([!#1])N1[CH2][CH2]O[CH2][CH2]1	PADEL_KR70
PADEL_KR71	[!#1][CH]([!#1])O[CH2][CH2]N([CH3])[CH3]	PADEL_KR71
PADEL_KR72	[!#1][CH]([!#1])OC(=O)[!#1]	PADEL_KR72
PADEL_KR73	[!#1][CH]([!#1])S(=O)(=O)[!#1]	PADEL_KR73
PADEL_KR74	[!#1][CH]([CH]([CH3])[CH3])C(=O)[OH]	PADEL_KR74
PADEL_KR75	[!#1][CH]([CH]=[CH]c1[cH][cH]c(Cl)[cH]c1Cl)C([CH3])([CH3])[CH3]	PADEL_KR75
PADEL_KR76	[!#1][CH]([CH2][CH2]C(=O)[OH])C(=O)[OH]	PADEL_KR76
PADEL_KR77	[!#1][CH]([CH2][CH2]S[CH3])C(=O)[OH]	PADEL_KR77
PADEL_KR78	[!#1][CH]([CH2][N+](=O)[O-])SC(=O)[CH3]	PADEL_KR78
PADEL_KR79	[!#1][CH]([CH2]C(=N[NH]C(=O)[!#1])[!#1])C(=O)[OH]	PADEL_KR79
PADEL_KR80	[!#1][CH]([CH2]C(=O)[!#1])C(=O)N([!#1])c1[cH][cH][cH][cH][cH]1	PADEL_KR80
PADEL_KR81	[!#1][CH]([CH2]C(=O)[!#1])C(=O)N([!#1])c1[cH][cH][cH]c([CH3])[cH]1	PADEL_KR81
PADEL_KR82	[!#1][CH]([CH2]C(=O)[!#1])C(=O)N([!#1])c1[cH][cH][cH]c(Br)[cH]1	PADEL_KR82
PADEL_KR83	[!#1][CH]([CH2]C(=O)[!#1])C(=O)N([!#1])c1[cH][cH][cH]c(Cl)[cH]1	PADEL_KR83
PADEL_KR84	[!#1][CH]([CH2]C(=O)[!#1])C(=O)N([!#1])c1[cH][cH]c([cH][cH]1)[N+](=O)[O-]	PADEL_KR84
PADEL_KR85	[!#1][CH]([CH2]C(=O)[!#1])C(=O)N([!#1])c1[cH][cH]c([cH][cH]1)C(=O)[OH]	PADEL_KR85
PADEL_KR86	[!#1][CH]([CH2]C(=O)[!#1])C(=O)N([!#1])c1[cH][cH]c(Br)[cH][cH]1	PADEL_KR86
PADEL_KR87	[!#1][CH]([CH2]C(=O)[!#1])C(=O)N([!#1])c1[cH][cH]c(Cl)[cH][cH]1	PADEL_KR87
PADEL_KR88	[!#1][CH]([CH2]C(=O)[NH2])C(=O)[OH]	PADEL_KR88
PADEL_KR89	[!#1][CH]([CH2]C(=O)[OH])[NH]C(=O)C(F)(F)F	PADEL_KR89
PADEL_KR90	[!#1][CH]([CH2]C(=O)[OH])C(=O)[OH]	PADEL_KR90
PADEL_KR91	[!#1][CH]([CH3])[CH2][CH3]	PADEL_KR91
PADEL_KR92	[!#1][CH]([CH3])[CH3]	PADEL_KR92
PADEL_KR93	[!#1][CH]([CH3])[NH]C(=O)[!#1]	PADEL_KR93
PADEL_KR94	[!#1][CH]([CH3])[NH]C(=O)[NH][CH2]C(=O)O[CH2][CH3]	PADEL_KR94
PADEL_KR95	[!#1][CH]([CH3])[NH]C(=S)[!#1]	PADEL_KR95
PADEL_KR96	[!#1][CH]([CH3])[NH]C(=S)[NH]C([!#1])([!#1])[!#1]	PADEL_KR96
PADEL_KR97	[!#1][CH]([CH3])[NH]S(=O)(=O)[!#1]	PADEL_KR97
PADEL_KR98	[!#1][CH]([CH3])C(=O)[!#1]	PADEL_KR98
PADEL_KR99	[!#1][CH]([CH3])C(=O)[OH]	PADEL_KR99
PADEL_KR100	[!#1][CH]([CH3])C(=O)O[CH2]C(=O)[!#1]	PADEL_KR100
PADEL_KR101	[!#1][CH]([CH3])c1[cH][cH][cH][cH][cH]1	PADEL_KR101
PADEL_KR102	[!#1][CH]([CH3])N([!#1])C(=O)[!#1]	PADEL_KR102
PADEL_KR103	[!#1][CH]([NH]C(=O)[!#1])[NH]C(=O)[!#1]	PADEL_KR103
PADEL_KR104	[!#1][CH]([NH]C(=O)[!#1])C(=O)[OH]	PADEL_KR104
PADEL_KR105	[!#1][CH]([NH]C(=O)[!#1])C(Br)(Br)Br	PADEL_KR105
PADEL_KR106	[!#1][CH]([NH]C(=O)[!#1])C(Cl)(Cl)Cl	PADEL_KR106
PADEL_KR107	[!#1][CH]([NH]C(=O)[CH2][CH2][CH2][CH2][CH3])C(Cl)(Cl)Cl	PADEL_KR107
PADEL_KR108	[!#1][CH]([NH]S(=O)(=O)[!#1])C(Cl)(Cl)Cl	PADEL_KR108
PADEL_KR109	[!#1][CH]([NH2])[CH2][CH3]	PADEL_KR109
PADEL_KR110	[!#1][CH]([NH2])[CH2]C(=O)[OH]	PADEL_KR110
PADEL_KR111	[!#1][CH]([NH2])C(=O)[OH]	PADEL_KR111
PADEL_KR112	[!#1][CH]([OH])[CH]([NH2])[CH2][OH]	PADEL_KR112
PADEL_KR113	[!#1][CH]([OH])[CH2][NH]C(=O)[!#1]	PADEL_KR113
PADEL_KR114	[!#1][CH]([OH])[CH2][NH2]	PADEL_KR114
PADEL_KR115	[!#1][CH]([OH])[CH2][OH]	PADEL_KR115
PADEL_KR116	[!#1][CH]([OH])C(=N[NH]C(=O)[!#1])[!#1]	PADEL_KR116
PADEL_KR117	[!#1][CH]([OH])C(Cl)(Cl)Cl	PADEL_KR117
PADEL_KR118	[!#1][CH]([OH])C(F)(F)F	PADEL_KR118
PADEL_KR119	[!#1][CH]([OH])c1[cH][cH][cH][cH][cH]1	PADEL_KR119
PADEL_KR120	[!#1][CH](C(=O)[CH3])C(=O)[CH3]	PADEL_KR120
PADEL_KR121	[!#1][CH](C(=O)O[CH2][CH3])C(=O)O[CH2][CH3]	PADEL_KR121
PADEL_KR122	[!#1][CH](C(=O)O[CH3])C(=O)O[CH3]	PADEL_KR122
PADEL_KR123	[!#1][CH](F)C(F)(F)F	PADEL_KR123
PADEL_KR124	[!#1][CH](F)OC(F)(F)F	PADEL_KR124
PADEL_KR125	[!#1][CH](OC(=O)[CH3])OC(=O)[CH3]	PADEL_KR125
PADEL_KR126	[!#1][CH]=[CH][!#1]	PADEL_KR126
PADEL_KR127	[!#1][CH]=[CH][CH]([!#1])C([CH3])([CH3])[CH3]	PADEL_KR127
PADEL_KR128	[!#1][CH]=[CH][CH]=C1SC(=S)N([!#1])C1=O	PADEL_KR128
PADEL_KR129	[!#1][CH]=[CH][CH]=N[!#1]	PADEL_KR129
PADEL_KR130	[!#1][CH]=[CH][CH]=N[NH]C(=O)[!#1]	PADEL_KR130
PADEL_KR131	[!#1][CH]=[CH]C(=N[NH]C(=O)[!#1])[!#1]	PADEL_KR131
PADEL_KR132	[!#1][CH]=[CH]C(=N[NH]C(=O)[!#1])[CH3]	PADEL_KR132
PADEL_KR133	[!#1][CH]=[CH]C(=O)[!#1]	PADEL_KR133
PADEL_KR134	[!#1][CH]=[CH]C(=O)[NH][NH]C(=O)[!#1]	PADEL_KR134
PADEL_KR135	[!#1][CH]=[CH]C(=O)[NH]C(=S)[!#1]	PADEL_KR135
PADEL_KR136	[!#1][CH]=[CH]C(=O)[OH]	PADEL_KR136
PADEL_KR137	[!#1][CH]=[CH]N([!#1])[CH3]	PADEL_KR137
PADEL_KR138	[!#1][CH]=[CH2]	PADEL_KR138
PADEL_KR139	[!#1][CH]=C([NH]C(=O)[!#1])C(=O)[!#1]	PADEL_KR139
PADEL_KR140	[!#1][CH]=C([NH]C(=O)[!#1])C(=O)[NH][CH2][CH2][CH2]N([CH3])[CH3]	PADEL_KR140
PADEL_KR141	[!#1][CH]=C(C#N)C#N	PADEL_KR141
PADEL_KR142	[!#1][CH]=C(C#N)C(=O)[NH2]	PADEL_KR142
PADEL_KR143	[!#1][CH]=C(C#N)C(=O)O[CH2][CH3]	PADEL_KR143
PADEL_KR144	[!#1][CH]=C(Cl)Cl	PADEL_KR144
PADEL_KR145	[!#1][CH]=C1[CH2]N([!#1])[CH2]C(=[CH][!#1])C1=O	PADEL_KR145
PADEL_KR146	[!#1][CH]=c1[nH]c(=O)c(=[CH][!#1])[nH]c1=O	PADEL_KR146
PADEL_KR147	[!#1][CH]=C1C(=NN(C1=O)c2[cH][cH]c([!#1])[cH][cH]2)[!#1]	PADEL_KR147
PADEL_KR148	[!#1][CH]=C1C(=O)[NH]C(=O)[NH]C1=O	PADEL_KR148
PADEL_KR149	[!#1][CH]=C1C(=O)[NH]C(=O)N([!#1])C1=O	PADEL_KR149
PADEL_KR150	[!#1][CH]=C1C(=O)[NH]C(=O)N(C1=O)c2[cH][cH][cH]c3[cH][cH][cH][cH]c23	PADEL_KR150
PADEL_KR151	[!#1][CH]=C1C(=O)c2[cH][cH][cH][cH]c2C1=O	PADEL_KR151
PADEL_KR152	[!#1][CH]=C1C(=O)N(N=C1c2[cH][cH][cH][cH][cH]2)c3[cH][cH]c([!#1])[cH][cH]3	PADEL_KR152
PADEL_KR153	[!#1][CH]=C1C(=O)OC([!#1])([CH3])OC1=O	PADEL_KR153
PADEL_KR154	[!#1][CH]=C1N=C(OC1=O)c2[cH][cH][cH][cH][cH]2	PADEL_KR154
PADEL_KR155	[!#1][CH]=C1OC(=O)c2c1[cH]c([!#1])[nH]c2=O	PADEL_KR155
PADEL_KR156	[!#1][CH]=C1SC(=N[!#1])[NH]C1=O	PADEL_KR156
PADEL_KR157	[!#1][CH]=C1SC(=O)N([!#1])C1=O	PADEL_KR157
PADEL_KR158	[!#1][CH]=C1SC(=S)[NH]C1=O	PADEL_KR158
PADEL_KR159	[!#1][CH]=C1SC(=S)N([!#1])C1=O	PADEL_KR159
PADEL_KR160	[!#1][CH]=C1SC(=S)N(C1=O)c2[cH][cH]c([!#1])[cH][cH]2	PADEL_KR160
PADEL_KR161	[!#1][CH]=N[!#1]	PADEL_KR161
PADEL_KR162	[!#1][CH]=N[CH]([!#1])[CH3]	PADEL_KR162
PADEL_KR163	[!#1][CH]=N[CH2][CH2][CH2][CH2][CH2][CH2]N=[CH][!#1]	PADEL_KR163
PADEL_KR164	[!#1][CH]=N[CH2][CH2][NH]C(=O)[!#1]	PADEL_KR164
PADEL_KR165	[!#1][CH]=N[CH2][CH2]N=[CH][!#1]	PADEL_KR165
PADEL_KR166	[!#1][CH]=N[NH]C(=[NH])[NH][N+](=O)[O-]	PADEL_KR166
PADEL_KR167	[!#1][CH]=N[NH]C(=[NH])[NH2]	PADEL_KR167
PADEL_KR168	[!#1][CH]=N[NH]C(=O)[!#1]	PADEL_KR168
PADEL_KR169	[!#1][CH]=N[NH]C(=O)[CH]([!#1])[CH3]	PADEL_KR169
PADEL_KR170	[!#1][CH]=N[NH]C(=O)[CH]([!#1])[NH]C(=O)[!#1]	PADEL_KR170
PADEL_KR171	[!#1][CH]=N[NH]C(=O)[CH]([!#1])[OH]	PADEL_KR171
PADEL_KR172	[!#1][CH]=N[NH]C(=O)[CH2][CH2][CH]([CH3])[OH]	PADEL_KR172
PADEL_KR173	[!#1][CH]=N[NH]C(=O)[CH2][CH2][CH2][CH2][CH2][CH2][CH3]	PADEL_KR173
PADEL_KR174	[!#1][CH]=N[NH]C(=O)[CH2][CH2][CH2][CH2][CH3]	PADEL_KR174
PADEL_KR175	[!#1][CH]=N[NH]C(=O)[CH2][NH]C(=O)[!#1]	PADEL_KR175
PADEL_KR176	[!#1][CH]=N[NH]C(=O)[CH2][OH]	PADEL_KR176
PADEL_KR177	[!#1][CH]=N[NH]C(=O)[CH2]C(=O)[NH]N=[CH][!#1]	PADEL_KR177
PADEL_KR178	[!#1][CH]=N[NH]C(=O)[NH2]	PADEL_KR178
PADEL_KR179	[!#1][CH]=N[NH]C(=O)C(=O)[NH]N=[CH][!#1]	PADEL_KR179
PADEL_KR180	[!#1][CH]=N[NH]C(=O)O[CH2][CH3]	PADEL_KR180
PADEL_KR181	[!#1][CH]=N[NH]C(=S)[NH2]	PADEL_KR181
PADEL_KR182	[!#1][CH]=N[NH]C(=S)S[CH3]	PADEL_KR182
PADEL_KR183	[!#1][CH]=N[NH]S(=O)(=O)[!#1]	PADEL_KR183
PADEL_KR184	[!#1][CH]=N[OH]	PADEL_KR184
PADEL_KR185	[!#1][CH]=NC(=N[NH]C(=O)[!#1])[!#1]	PADEL_KR185
PADEL_KR186	[!#1][CH]=NN([!#1])[CH3]	PADEL_KR186
PADEL_KR187	[!#1][CH]=NN=[CH][!#1]	PADEL_KR187
PADEL_KR188	[!#1][CH]=NOC(=O)[!#1]	PADEL_KR188
PADEL_KR189	[!#1][CH]=O	PADEL_KR189
PADEL_KR190	[!#1][CH]1[CH]([!#1])[CH]2[CH2][CH]1[CH]=[CH]2	PADEL_KR190
PADEL_KR191	[!#1][CH]1[CH]([!#1])[CH]2c3[cH][cH][cH][cH]c3[CH]1c4[cH][cH][cH][cH]c24	PADEL_KR191
PADEL_KR192	[!#1][CH]1[CH]([CH]2[CH2][CH]1[CH]=[CH]2)C(=O)[OH]	PADEL_KR192
PADEL_KR193	[!#1][CH]1[CH]([CH]2c3[cH][cH][cH][cH]c3[CH]1c4[cH][cH][cH][cH]c24)C(=O)[OH]	PADEL_KR193
PADEL_KR194	[!#1][CH]1[CH]([OH])O[CH]([CH2][OH])[CH]([OH])[CH]1[OH]	PADEL_KR194
PADEL_KR195	[!#1][CH]1[CH]2[CH2][CH]3[CH2][CH]([CH2]2)[CH2][CH]1[CH2]3	PADEL_KR195
PADEL_KR196	[!#1][CH]1[CH]2[CH2][CH2][CH2][CH2][CH]12	PADEL_KR196
PADEL_KR197	[!#1][CH]1[CH]2S[CH2]C1([!#1])[CH2][CH2][CH]2[!#1]	PADEL_KR197
PADEL_KR198	[!#1][CH]1[CH2][CH]([CH3])[CH2][CH2][CH]1[CH]([CH3])[CH3]	PADEL_KR198
PADEL_KR199	[!#1][CH]1[CH2][CH]=[CH][CH2][CH]1[!#1]	PADEL_KR199
PADEL_KR200	[!#1][CH]1[CH2][CH]=[CH][CH2][CH]1C(=O)[OH]	PADEL_KR200
PADEL_KR201	[!#1][CH]1[CH2][CH]1[!#1]	PADEL_KR201
PADEL_KR202	[!#1][CH]1[CH2][CH]1c2[cH][cH][cH][cH][cH]2	PADEL_KR202
PADEL_KR203	[!#1][CH]1[CH2][CH]2[CH2][CH2][CH]([CH2]1)N2[!#1]	PADEL_KR203
PADEL_KR204	[!#1][CH]1[CH2][CH]2[CH2][CH2][CH]([CH2]1)N2[CH3]	PADEL_KR204
PADEL_KR205	[!#1][CH]1[CH2][CH]2[CH2][CH2][CH]1[CH2]2	PADEL_KR205
PADEL_KR206	[!#1][CH]1[CH2][CH]2[CH2][CH2]N1[CH2][CH]2[CH]=[CH2]	PADEL_KR206
PADEL_KR207	[!#1][CH]1[CH2][CH2][CH]([!#1])[CH]([!#1])[CH2]1	PADEL_KR207
PADEL_KR208	[!#1][CH]1[CH2][CH2][CH]([!#1])[CH2][CH2]1	PADEL_KR208
PADEL_KR209	[!#1][CH]1[CH2][CH2][CH]([CH2][CH2]1)C([CH3])([CH3])[CH3]	PADEL_KR209
PADEL_KR210	[!#1][CH]1[CH2][CH2][CH]2[CH2][CH2][CH2][NH][CH]2[CH2]1	PADEL_KR210
PADEL_KR211	[!#1][CH]1[CH2][CH2][CH2][CH]([!#1])N1[!#1]	PADEL_KR211
PADEL_KR212	[!#1][CH]1[CH2][CH2][CH2][CH2][CH]1[!#1]	PADEL_KR212
PADEL_KR213	[!#1][CH]1[CH2][CH2][CH2][CH2][CH2][CH2][CH2]1	PADEL_KR213
PADEL_KR214	[!#1][CH]1[CH2][CH2][CH2][CH2][CH2]1	PADEL_KR214
PADEL_KR215	[!#1][CH]1[CH2][CH2][CH2][CH2][NH]C1=O	PADEL_KR215
PADEL_KR216	[!#1][CH]1[CH2][CH2][CH2][CH2]1	PADEL_KR216
PADEL_KR217	[!#1][CH]1[CH2][CH2][CH2][CH2]C1=O	PADEL_KR217
PADEL_KR218	[!#1][CH]1[CH2][CH2][CH2][CH2]N1[!#1]	PADEL_KR218
PADEL_KR219	[!#1][CH]1[CH2][CH2][CH2]C1=N[NH]C(=S)[NH2]	PADEL_KR219
PADEL_KR220	[!#1][CH]1[CH2][CH2][CH2]c2c1[nH]c3[cH][cH]c([!#1])[cH]c23	PADEL_KR220
PADEL_KR221	[!#1][CH]1[CH2][CH2][CH2]c2c1[nH]c3[cH][cH]c([cH]c23)c4[cH][cH][cH][cH][cH]4	PADEL_KR221
PADEL_KR222	[!#1][CH]1[CH2][CH2][CH2]c2c1[nH]c3[cH][cH]c([CH3])[cH]c23	PADEL_KR222
PADEL_KR223	[!#1][CH]1[CH2][CH2][CH2]N([!#1])[CH2]1	PADEL_KR223
PADEL_KR224	[!#1][CH]1[CH2][CH2][CH2]N1[!#1]	PADEL_KR224
PADEL_KR225	[!#1][CH]1[CH2][CH2][CH2]O1	PADEL_KR225
PADEL_KR226	[!#1][CH]1[CH2][CH2][NH][CH2][CH2]1	PADEL_KR226
PADEL_KR227	[!#1][CH]1[CH2][CH2][NH]C(=O)[NH]1	PADEL_KR227
PADEL_KR228	[!#1][CH]1[CH2][CH2]1	PADEL_KR228
PADEL_KR229	[!#1][CH]1[CH2][CH2]C([!#1])(C(=O)[OH])C1([!#1])[CH3]	PADEL_KR229
PADEL_KR230	[!#1][CH]1[CH2][CH2]C([CH3])(C(=O)[OH])C1([CH3])[CH3]	PADEL_KR230
PADEL_KR231	[!#1][CH]1[CH2][CH2]c2c([!#1])c([!#1])sc2C1=O	PADEL_KR231
PADEL_KR232	[!#1][CH]1[CH2][CH2]N([!#1])[CH2][CH2]1	PADEL_KR232
PADEL_KR233	[!#1][CH]1[CH2][CH2]OC1=O	PADEL_KR233
PADEL_KR234	[!#1][CH]1[CH2][CH2]S(=O)(=O)[CH2]1	PADEL_KR234
PADEL_KR235	[!#1][CH]1[CH2][NH]c2[cH][cH][cH][cH]c12	PADEL_KR235
PADEL_KR236	[!#1][CH]1[CH2]C([!#1])([CH]([!#1])[CH2]N1[!#1])c2[cH][cH][cH][cH][cH]2	PADEL_KR236
PADEL_KR237	[!#1][CH]1[CH2]C([!#1])([CH3])[NH]C([!#1])([CH3])[CH2]1	PADEL_KR237
PADEL_KR238	[!#1][CH]1[CH2]C([CH3])([CH3])[NH]C([CH3])([CH3])[CH2]1	PADEL_KR238
PADEL_KR239	[!#1][CH]1[CH2]C(=O)N(C1=O)c2[cH][cH][cH][cH][cH]2	PADEL_KR239
PADEL_KR240	[!#1][CH]1[CH2]C(=O)N(C1=O)c2[cH][cH][cH]c([!#1])[cH]2	PADEL_KR240
PADEL_KR241	[!#1][CH]1[CH2]C(=O)N(C1=O)c2[cH][cH][cH]c(Cl)[cH]2	PADEL_KR241
PADEL_KR242	[!#1][CH]1[CH2]C(=O)N(C1=O)c2[cH][cH][cH]c3[cH][cH][cH][cH]c23	PADEL_KR242
PADEL_KR243	[!#1][CH]1[CH2]C(=O)N(C1=O)c2[cH][cH]c([!#1])[cH][cH]2	PADEL_KR243
PADEL_KR244	[!#1][CH]1[CH2]C(=O)N(C1=O)c2[cH][cH]c(Br)[cH][cH]2	PADEL_KR244
PADEL_KR245	[!#1][CH]1[CH2]C(=O)N(C1=O)c2[cH][cH]c(Cl)[cH][cH]2	PADEL_KR245
PADEL_KR246	[!#1][CH]1[CH2]C(=O)N(C1=O)c2[cH][cH]c(O[CH3])[cH][cH]2	PADEL_KR246
PADEL_KR247	[!#1][CH]1[CH2]C(=O)N(N([CH3])[CH3])C1=O	PADEL_KR247
PADEL_KR248	[!#1][CH]1[CH2]C(=O)O[CH]1c2[cH][cH][cH][cH][cH]2	PADEL_KR248
PADEL_KR249	[!#1][CH]1[CH2]C1([!#1])[CH3]	PADEL_KR249
PADEL_KR250	[!#1][CH]1[CH2]C1([CH3])[CH3]	PADEL_KR250
PADEL_KR251	[!#1][CH]1[CH2]C1(c2[cH][cH][cH][cH][cH]2)c3[cH][cH][cH][cH][cH]3	PADEL_KR251
PADEL_KR252	[!#1][CH]1[CH2]C1(c2[cH][cH]c([!#1])[cH][cH]2)c3[cH][cH]c([!#1])[cH][cH]3	PADEL_KR252
PADEL_KR253	[!#1][CH]1[CH2]C1(c2[cH][cH]c([CH3])[cH][cH]2)c3[cH][cH]c([CH3])[cH][cH]3	PADEL_KR253
PADEL_KR254	[!#1][CH]1[CH2]C2([!#1])[CH2]C([!#1])([CH2][CH]([!#1])C2=O)C1=O	PADEL_KR254
PADEL_KR255	[!#1][CH]1[CH2]c2[cH][cH][cH]c3[cH][cH][cH]c1c23	PADEL_KR255
PADEL_KR256	[!#1][CH]1[CH2]C21[CH2][CH2][CH2]2	PADEL_KR256
PADEL_KR257	[!#1][CH]1[CH2]c2c([nH]c3[cH][cH][cH][cH]c23)[CH]([!#1])[NH]1	PADEL_KR257
PADEL_KR258	[!#1][CH]1[CH2]c2c([nH]c3[cH][cH][cH][cH]c23)[CH]([NH]1)c4[cH][cH]c([!#1])[cH][cH]4	PADEL_KR258
PADEL_KR259	[!#1][CH]1[CH2]N2[CH2][CH2][CH]1[CH2][CH]2[!#1]	PADEL_KR259
PADEL_KR260	[!#1][CH]1[CH2]O[CH]([!#1])O1	PADEL_KR260
PADEL_KR261	[!#1][CH]1[CH2]O1	PADEL_KR261
PADEL_KR262	[!#1][CH]1[CH2]OC([!#1])([CH3])O1	PADEL_KR262
PADEL_KR263	[!#1][CH]1[CH2]OC2([CH2][CH2][CH2][CH2][CH2]2)O1	PADEL_KR263
PADEL_KR264	[!#1][CH]1[CH2]Oc2[cH][cH][cH][cH]c2O1	PADEL_KR264
PADEL_KR265	[!#1][CH]1[CH2]S(=O)(=O)[CH]=[CH]1	PADEL_KR265
PADEL_KR266	[!#1][CH]1[CH2]S(=O)(=O)[CH2][CH]1[!#1]	PADEL_KR266
PADEL_KR267	[!#1][CH]1[CH2]S(=O)(=O)[CH2][CH]1[OH]	PADEL_KR267
PADEL_KR268	[!#1][CH]1[CH2]S[CH]([NH]1)c2[cH][cH]c([!#1])[cH][cH]2	PADEL_KR268
PADEL_KR269	[!#1][CH]1[CH2]S[CH](N1[!#1])c2[cH][cH]c([!#1])[cH][cH]2	PADEL_KR269
PADEL_KR270	[!#1][CH]1[CH2]S[CH2][CH]1[!#1]	PADEL_KR270
PADEL_KR271	[!#1][CH]1[NH][CH2][CH2]n2[cH][cH][cH]c12	PADEL_KR271
PADEL_KR272	[!#1][CH]1[NH]c2[cH][cH][cH][cH]c2[NH]C1=O	PADEL_KR272
PADEL_KR273	[!#1][CH]1C(=NN(C1=O)c2[cH][cH][cH][cH][cH]2)[!#1]	PADEL_KR273
PADEL_KR274	[!#1][CH]1C(=NN(C1=O)c2c([!#1])c([!#1])c([!#1])c([!#1])c2[!#1])[!#1]	PADEL_KR274
PADEL_KR275	[!#1][CH]1C(=NN(C1=O)c2c(F)c(F)c(F)c(F)c2F)[CH3]	PADEL_KR275
PADEL_KR276	[!#1][CH]1C(=O)[CH2]C([!#1])([CH3])[CH2]C1=O	PADEL_KR276
PADEL_KR277	[!#1][CH]1C(=O)[CH2]C([CH3])([CH3])[CH2]C1=O	PADEL_KR277
PADEL_KR278	[!#1][CH]1C(=O)[NH]C(=O)[NH]C1=O	PADEL_KR278
PADEL_KR279	[!#1][CH]1C(=O)c2[cH][cH][cH][cH]c2C1=O	PADEL_KR279
PADEL_KR280	[!#1][CH]1c2[cH][cH][cH][cH]c2-c3[cH][cH][cH][cH]c13	PADEL_KR280
PADEL_KR281	[!#1][CH]1c2[cH][cH][cH][cH]c2Oc3[cH][cH][cH][cH]c13	PADEL_KR281
PADEL_KR282	[!#1][CH]1N([!#1])[CH2][CH2]c2[cH][cH][cH][cH]c12	PADEL_KR282
PADEL_KR283	[!#1][CH]1N(C(=O)N([!#1])C1([!#1])[CH3])c2[cH][cH][cH]c3[cH][cH][cH][cH]c23	PADEL_KR283
PADEL_KR284	[!#1][CH]1N(C(=O)N([!#1])C1([!#1])[CH3])c2[cH][cH]c([!#1])c([!#1])[cH]2	PADEL_KR284
PADEL_KR285	[!#1][CH]1N(C(=O)N([!#1])C1([CH3])[CH3])c2[cH][cH][cH]c3[cH][cH][cH][cH]c23	PADEL_KR285
PADEL_KR286	[!#1][CH]1N2[CH2][CH2][CH]([CH2][CH2]2)C1=O	PADEL_KR286
PADEL_KR287	[!#1][CH]1O[CH]([!#1])[CH]([!#1])[CH]([!#1])[CH]1[!#1]	PADEL_KR287
PADEL_KR288	[!#1][CH]1O[CH]([CH]([!#1])[CH]1[!#1])n2[cH][cH]c(=O)[nH]c2=O	PADEL_KR288
PADEL_KR289	[!#1][CH]1O[CH]([CH]([!#1])[CH]1[!#1])n2[cH]nc3c([!#1])n[cH]nc23	PADEL_KR289
PADEL_KR290	[!#1][CH]1O[CH]([CH2][OH])[CH]([OH])[CH]([OH])[CH]1[OH]	PADEL_KR290
PADEL_KR291	[!#1][CH]1O[CH]([CH2][OH])[CH]([OH])[CH]1[OH]	PADEL_KR291
PADEL_KR292	[!#1][CH]1O[CH]([CH3])[CH]([OH])[CH]([OH])[CH]1[OH]	PADEL_KR292
PADEL_KR293	[!#1][CH]1O[CH2][CH2]O[CH]1[!#1]	PADEL_KR293
PADEL_KR294	[!#1][CH]1OC([!#1])([CH3])O[CH]1[!#1]	PADEL_KR294
PADEL_KR295	[!#1][CH]1S(=O)(=O)[CH2][CH]([CH2]S1(=O)=O)c2[cH][cH][cH][cH][cH]2	PADEL_KR295
PADEL_KR296	[!#1][CH]1S(c2[cH][cH][cH][cH]c2[NH]C1=O)	PADEL_KR296
PADEL_KR297	[!#1][CH2][!#1]	PADEL_KR297
PADEL_KR298	[!#1][CH2][CH]([!#1])[!#1]	PADEL_KR298
PADEL_KR299	[!#1][CH2][CH]([!#1])[CH3]	PADEL_KR299
PADEL_KR300	[!#1][CH2][CH]([!#1])[OH]	PADEL_KR300
PADEL_KR301	[!#1][CH2][CH]([!#1])C#[CH]	PADEL_KR301
PADEL_KR302	[!#1][CH2][CH]([!#1])C(=O)[!#1]	PADEL_KR302
PADEL_KR303	[!#1][CH2][CH]([!#1])C(=O)[NH][!#1]	PADEL_KR303
PADEL_KR304	[!#1][CH2][CH]([!#1])C(=O)[OH]	PADEL_KR304
PADEL_KR305	[!#1][CH2][CH]([!#1])C(=O)O[CH2][CH3]	PADEL_KR305
PADEL_KR306	[!#1][CH2][CH]([CH2][CH3])[NH]C(=O)[!#1]	PADEL_KR306
PADEL_KR307	[!#1][CH2][CH]([CH3])[CH3]	PADEL_KR307
PADEL_KR308	[!#1][CH2][CH]([CH3])[NH][CH2]C(=O)[NH][!#1]	PADEL_KR308
PADEL_KR309	[!#1][CH2][CH]([CH3])[NH]C(=O)[!#1]	PADEL_KR309
PADEL_KR310	[!#1][CH2][CH]([CH3])[NH2]	PADEL_KR310
PADEL_KR311	[!#1][CH2][CH]([CH3])[OH]	PADEL_KR311
PADEL_KR312	[!#1][CH2][CH]([CH3])O[!#1]	PADEL_KR312
PADEL_KR313	[!#1][CH2][CH]([CH3])S[CH2][CH3]	PADEL_KR313
PADEL_KR314	[!#1][CH2][CH]([NH]C(=O)[!#1])C(=O)[NH][!#1]	PADEL_KR314
PADEL_KR315	[!#1][CH2][CH]([NH]C(=O)[!#1])C(=O)[OH]	PADEL_KR315
PADEL_KR316	[!#1][CH2][CH]([NH]C(=O)[!#1])C(=O)O[CH2][CH3]	PADEL_KR316
PADEL_KR317	[!#1][CH2][CH]([NH]C(=O)[!#1])C(=O)O[CH3]	PADEL_KR317
PADEL_KR318	[!#1][CH2][CH]([NH]C(=O)[CH2]O[!#1])C(=O)[OH]	PADEL_KR318
PADEL_KR319	[!#1][CH2][CH]([NH]C(=O)[CH2]O[!#1])C(=O)O[CH3]	PADEL_KR319
PADEL_KR320	[!#1][CH2][CH]([NH]C(=O)[CH3])C(=O)[OH]	PADEL_KR320
PADEL_KR321	[!#1][CH2][CH]([NH]C(=O)[CH3])C(=O)O[CH2][CH3]	PADEL_KR321
PADEL_KR322	[!#1][CH2][CH]([NH]C(=O)OC([CH3])([CH3])[CH3])C(=O)O[!#1]	PADEL_KR322
PADEL_KR323	[!#1][CH2][CH]([NH]S(=O)(=O)[!#1])C(=O)[OH]	PADEL_KR323
PADEL_KR324	[!#1][CH2][CH]([NH]S(=O)(=O)[!#1])C(=O)O[CH3]	PADEL_KR324
PADEL_KR325	[!#1][CH2][CH]([NH2])C(=O)[OH]	PADEL_KR325
PADEL_KR326	[!#1][CH2][CH]([OH])[CH2][!#1]	PADEL_KR326
PADEL_KR327	[!#1][CH2][CH]([OH])[CH2][NH][!#1]	PADEL_KR327
PADEL_KR328	[!#1][CH2][CH]([OH])[CH2][OH]	PADEL_KR328
PADEL_KR329	[!#1][CH2][CH]([OH])[CH2]Br	PADEL_KR329
PADEL_KR330	[!#1][CH2][CH]([OH])[CH2]Cl	PADEL_KR330
PADEL_KR331	[!#1][CH2][CH]([OH])[CH2]N([!#1])[!#1]	PADEL_KR331
PADEL_KR332	[!#1][CH2][CH]([OH])[CH2]N([!#1])[CH3]	PADEL_KR332
PADEL_KR333	[!#1][CH2][CH]([OH])[CH2]N([CH2][CH2][OH])[CH2][CH2][OH]	PADEL_KR333
PADEL_KR334	[!#1][CH2][CH]([OH])[CH2]N([CH2][CH3])[CH2][CH3]	PADEL_KR334
PADEL_KR335	[!#1][CH2][CH]([OH])[CH2]N([CH3])[CH3]	PADEL_KR335
PADEL_KR336	[!#1][CH2][CH]([OH])[CH2]O[!#1]	PADEL_KR336
PADEL_KR337	[!#1][CH2][CH](O[CH3])O[CH3]	PADEL_KR337
PADEL_KR338	[!#1][CH2][CH]=[CH][!#1]	PADEL_KR338
PADEL_KR339	[!#1][CH2][CH]=[CH2]	PADEL_KR339
PADEL_KR340	[!#1][CH2][CH]1[CH2]OC2([CH2][CH2][CH2][CH2][CH2]2)O1	PADEL_KR340
PADEL_KR341	[!#1][CH2][CH2][!#1]	PADEL_KR341
PADEL_KR342	[!#1][CH2][CH2][CH]([CH3])[CH3]	PADEL_KR342
PADEL_KR343	[!#1][CH2][CH2][CH]=C([CH3])[CH3]	PADEL_KR343
PADEL_KR344	[!#1][CH2][CH2][CH2][!#1]	PADEL_KR344
PADEL_KR345	[!#1][CH2][CH2][CH2][CH]([CH2]O[!#1])O[!#1]	PADEL_KR345
PADEL_KR346	[!#1][CH2][CH2][CH2][CH2][!#1]	PADEL_KR346
PADEL_KR347	[!#1][CH2][CH2][CH2][CH2][CH2][!#1]	PADEL_KR347
PADEL_KR348	[!#1][CH2][CH2][CH2][CH2][CH2][CH2][!#1]	PADEL_KR348
PADEL_KR349	[!#1][CH2][CH2][CH2][CH2][CH2][CH2][CH2][CH3]	PADEL_KR349
PADEL_KR350	[!#1][CH2][CH2][CH2][CH2][CH2][CH3]	PADEL_KR350
PADEL_KR351	[!#1][CH2][CH2][CH2][CH2][CH2]C(=O)[NH][!#1]	PADEL_KR351
PADEL_KR352	[!#1][CH2][CH2][CH2][CH2][CH2]C(=O)[OH]	PADEL_KR352
PADEL_KR353	[!#1][CH2][CH2][CH2][CH2][CH2]C(=O)N([!#1])[CH2][!#1]	PADEL_KR353
PADEL_KR354	[!#1][CH2][CH2][CH2][CH2][CH3]	PADEL_KR354
PADEL_KR355	[!#1][CH2][CH2][CH2][CH2][NH]C(=O)[!#1]	PADEL_KR355
PADEL_KR356	[!#1][CH2][CH2][CH2][CH2][NH]C(=S)[NH][CH3]	PADEL_KR356
PADEL_KR357	[!#1][CH2][CH2][CH2][CH2][OH]	PADEL_KR357
PADEL_KR358	[!#1][CH2][CH2][CH2][CH2]C(=O)[OH]	PADEL_KR358
PADEL_KR359	[!#1][CH2][CH2][CH2][CH2]C(=O)O[CH3]	PADEL_KR359
PADEL_KR360	[!#1][CH2][CH2][CH2][CH2]N([!#1])C(=O)[!#1]	PADEL_KR360
PADEL_KR361	[!#1][CH2][CH2][CH2][CH2]S[!#1]	PADEL_KR361
PADEL_KR362	[!#1][CH2][CH2][CH2][CH3]	PADEL_KR362
PADEL_KR363	[!#1][CH2][CH2][CH2][NH][!#1]	PADEL_KR363
PADEL_KR364	[!#1][CH2][CH2][CH2][NH]C(=O)[!#1]	PADEL_KR364
PADEL_KR365	[!#1][CH2][CH2][CH2][NH]S(=O)(=O)[!#1]	PADEL_KR365
PADEL_KR366	[!#1][CH2][CH2][CH2][NH2]	PADEL_KR366
PADEL_KR367	[!#1][CH2][CH2][CH2][OH]	PADEL_KR367
PADEL_KR368	[!#1][CH2][CH2][CH2]C(=O)[!#1]	PADEL_KR368
PADEL_KR369	[!#1][CH2][CH2][CH2]C(=O)[NH][!#1]	PADEL_KR369
PADEL_KR370	[!#1][CH2][CH2][CH2]C(=O)[OH]	PADEL_KR370
PADEL_KR371	[!#1][CH2][CH2][CH2]C(=O)O[CH3]	PADEL_KR371
PADEL_KR372	[!#1][CH2][CH2][CH2]Cl	PADEL_KR372
PADEL_KR373	[!#1][CH2][CH2][CH2]N([CH2][CH3])[CH2][CH3]	PADEL_KR373
PADEL_KR374	[!#1][CH2][CH2][CH2]N([CH3])[CH3]	PADEL_KR374
PADEL_KR375	[!#1][CH2][CH2][CH2]O[!#1]	PADEL_KR375
PADEL_KR376	[!#1][CH2][CH2][CH2]OC(=O)[!#1]	PADEL_KR376
PADEL_KR377	[!#1][CH2][CH2][CH2]OC(=O)C([!#1])([!#1])[OH]	PADEL_KR377
PADEL_KR378	[!#1][CH2][CH2][CH2]OC(=O)C([CH3])([CH3])[CH3]	PADEL_KR378
PADEL_KR379	[!#1][CH2][CH2][CH2]S(=O)(=O)[OH]	PADEL_KR379
PADEL_KR380	[!#1][CH2][CH2][CH2]S(=O)(=O)O[Na]	PADEL_KR380
PADEL_KR381	[!#1][CH2][CH2][CH2]S[!#1]	PADEL_KR381
PADEL_KR382	[!#1][CH2][CH2][CH3]	PADEL_KR382
PADEL_KR383	[!#1][CH2][CH2][NH][!#1]	PADEL_KR383
PADEL_KR384	[!#1][CH2][CH2][NH][CH2]C(=O)[NH][!#1]	PADEL_KR384
PADEL_KR385	[!#1][CH2][CH2][NH]C([!#1])([!#1])[!#1]	PADEL_KR385
PADEL_KR386	[!#1][CH2][CH2][NH]C(=C1C(=O)O[CH](C1=O)c2[cH][cH][cH][cH][cH]2)[CH3]	PADEL_KR386
PADEL_KR387	[!#1][CH2][CH2][NH]C(=O)[!#1]	PADEL_KR387
PADEL_KR388	[!#1][CH2][CH2][NH]C(=O)[CH]([!#1])[CH3]	PADEL_KR388
PADEL_KR389	[!#1][CH2][CH2][NH]C(=O)[CH]=[CH][!#1]	PADEL_KR389
PADEL_KR390	[!#1][CH2][CH2][NH]C(=O)[CH2][!#1]	PADEL_KR390
PADEL_KR391	[!#1][CH2][CH2][NH]C(=O)[CH2][CH2][!#1]	PADEL_KR391
PADEL_KR392	[!#1][CH2][CH2][NH]C(=O)[CH2]O[!#1]	PADEL_KR392
PADEL_KR393	[!#1][CH2][CH2][NH]C(=O)[CH3]	PADEL_KR393
PADEL_KR394	[!#1][CH2][CH2][NH]C(=O)[NH][!#1]	PADEL_KR394
PADEL_KR395	[!#1][CH2][CH2][NH]C(=O)O[CH2][CH2]Cl	PADEL_KR395
PADEL_KR396	[!#1][CH2][CH2][NH]S(=O)(=O)[!#1]	PADEL_KR396
PADEL_KR397	[!#1][CH2][CH2][NH2]	PADEL_KR397
PADEL_KR398	[!#1][CH2][CH2][OH]	PADEL_KR398
PADEL_KR399	[!#1][CH2][CH2]C#N	PADEL_KR399
PADEL_KR400	[!#1][CH2][CH2]C(=N[OH])[!#1]	PADEL_KR400
PADEL_KR401	[!#1][CH2][CH2]C(=O)[!#1]	PADEL_KR401
PADEL_KR402	[!#1][CH2][CH2]C(=O)[CH3]	PADEL_KR402
PADEL_KR403	[!#1][CH2][CH2]C(=O)[NH][!#1]	PADEL_KR403
PADEL_KR404	[!#1][CH2][CH2]C(=O)[NH][NH]C(=O)[!#1]	PADEL_KR404
PADEL_KR405	[!#1][CH2][CH2]C(=O)[NH][NH]S(=O)(=O)[!#1]	PADEL_KR405
PADEL_KR406	[!#1][CH2][CH2]C(=O)[NH][NH2]	PADEL_KR406
PADEL_KR407	[!#1][CH2][CH2]C(=O)[NH]N=[CH][!#1]	PADEL_KR407
PADEL_KR408	[!#1][CH2][CH2]C(=O)[NH2]	PADEL_KR408
PADEL_KR409	[!#1][CH2][CH2]C(=O)[OH]	PADEL_KR409
PADEL_KR410	[!#1][CH2][CH2]C(=O)O[!#1]	PADEL_KR410
PADEL_KR411	[!#1][CH2][CH2]C(=O)O[CH2][CH3]	PADEL_KR411
PADEL_KR412	[!#1][CH2][CH2]C(=O)O[CH3]	PADEL_KR412
PADEL_KR413	[!#1][CH2][CH2]c1[cH][cH][cH][cH][cH]1	PADEL_KR413
PADEL_KR414	[!#1][CH2][CH2]c1[cH][cH]c(O[!#1])c(O[!#1])[cH]1	PADEL_KR414
PADEL_KR415	[!#1][CH2][CH2]c1c(nc2[cH][cH][cH][cH]c2c1[NH][!#1])N([!#1])[CH2]c3[cH][cH][cH][cH][cH]3	PADEL_KR415
PADEL_KR416	[!#1][CH2][CH2]c1c(nc2[cH][cH][cH][cH]c2c1[NH][!#1])N([!#1])[CH3]	PADEL_KR416
PADEL_KR417	[!#1][CH2][CH2]N([!#1])[CH]1[CH2][CH2][CH2]c2c1n([!#1])c3[cH][cH]c([CH3])[cH]c23	PADEL_KR417
PADEL_KR418	[!#1][CH2][CH2]N([!#1])[CH2][CH2][NH][!#1]	PADEL_KR418
PADEL_KR419	[!#1][CH2][CH2]N([!#1])[CH2][CH2]N([!#1])[CH2][CH]([!#1])[!#1]	PADEL_KR419
PADEL_KR420	[!#1][CH2][CH2]N([!#1])[CH2][CH2]N([!#1])[CH2][CH]([OH])[CH2]O[!#1]	PADEL_KR420
PADEL_KR421	[!#1][CH2][CH2]N([!#1])[CH2][CH2]N([!#1])[CH2]C(=O)[!#1]	PADEL_KR421
PADEL_KR422	[!#1][CH2][CH2]N([!#1])[CH2][CH2]N([!#1])[CH2]c1[cH][cH][cH][cH][cH]1	PADEL_KR422
PADEL_KR423	[!#1][CH2][CH2]N([!#1])[CH2][CH2]N([!#1])[CH2]c1[cH][cH]c2O[CH2]Oc2[cH]1	PADEL_KR423
PADEL_KR424	[!#1][CH2][CH2]N([!#1])[CH2][CH2]N([!#1])[CH3]	PADEL_KR424
PADEL_KR425	[!#1][CH2][CH2]N([!#1])[CH2][CH2]N([!#1])c1[cH][cH][cH][cH][cH]1	PADEL_KR425
PADEL_KR426	[!#1][CH2][CH2]N([!#1])[CH2][CH2]N([!#1])c1[cH][cH][cH][cH]c1O[!#1]	PADEL_KR426
PADEL_KR427	[!#1][CH2][CH2]N([!#1])[CH2][CH2]N([!#1])c1[cH][cH][cH][cH]n1	PADEL_KR427
PADEL_KR428	[!#1][CH2][CH2]N([!#1])[CH2][CH2]N([!#1])c1[cH][cH]c([!#1])[cH][cH]1	PADEL_KR428
PADEL_KR429	[!#1][CH2][CH2]N([!#1])[CH2][CH2]N([!#1])c1[cH][cH]c([cH][cH]1)[N+](=O)[O-]	PADEL_KR429
PADEL_KR430	[!#1][CH2][CH2]N([!#1])[CH2][CH2]N([!#1])c1[cH][cH]c(Cl)[cH][cH]1	PADEL_KR430
PADEL_KR431	[!#1][CH2][CH2]N([!#1])[CH2][CH2]N([!#1])c1[cH][cH]c(F)[cH][cH]1	PADEL_KR431
PADEL_KR432	[!#1][CH2][CH2]N([!#1])[CH2][CH2]N([!#1])c1n[cH][cH][cH]n1	PADEL_KR432
PADEL_KR433	[!#1][CH2][CH2]N([!#1])[CH2][CH2]O[!#1]	PADEL_KR433
PADEL_KR434	[!#1][CH2][CH2]N([!#1])[CH2][CH3]	PADEL_KR434
PADEL_KR435	[!#1][CH2][CH2]N([!#1])[CH3]	PADEL_KR435
PADEL_KR436	[!#1][CH2][CH2]N([!#1])[NH2]	PADEL_KR436
PADEL_KR437	[!#1][CH2][CH2]N([!#1])c1[cH][cH][cH][cH][cH]1	PADEL_KR437
PADEL_KR438	[!#1][CH2][CH2]N([CH2][!#1])[CH2][!#1]	PADEL_KR438
PADEL_KR439	[!#1][CH2][CH2]N([CH2][CH2]O[!#1])C(=O)[!#1]	PADEL_KR439
PADEL_KR440	[!#1][CH2][CH2]N([CH2][CH3])[CH2][CH3]	PADEL_KR440
PADEL_KR441	[!#1][CH2][CH2]N([CH3])[CH2]C(=O)[NH][!#1]	PADEL_KR441
PADEL_KR442	[!#1][CH2][CH2]N([CH3])[CH3]	PADEL_KR442
PADEL_KR443	[!#1][CH2][CH2]N=[CH][!#1]	PADEL_KR443
PADEL_KR444	[!#1][CH2][CH2]O[!#1]	PADEL_KR444
PADEL_KR445	[!#1][CH2][CH2]O[CH2][CH]([OH])[CH2][!#1]	PADEL_KR445
PADEL_KR446	[!#1][CH2][CH2]O[CH2][CH]([OH])[CH2][NH2]	PADEL_KR446
PADEL_KR447	[!#1][CH2][CH2]OC(=O)[!#1]	PADEL_KR447
PADEL_KR448	[!#1][CH2][CH2]OC(=O)[CH2][CH2]C(=O)[NH][!#1]	PADEL_KR448
PADEL_KR449	[!#1][CH2][CH2]OC(=O)[CH3]	PADEL_KR449
PADEL_KR450	[!#1][CH2][CH2]OC(=O)[NH][CH]([!#1])C(Cl)(Cl)Cl	PADEL_KR450
PADEL_KR451	[!#1][CH2][CH2]OC(=O)[NH][CH]([NH][!#1])C(Cl)(Cl)Cl	PADEL_KR451
PADEL_KR452	[!#1][CH2][CH2]P(=O)([!#1])[CH2][CH3]	PADEL_KR452
PADEL_KR453	[!#1][CH2][CH2]S(=O)(=O)[!#1]	PADEL_KR453
PADEL_KR454	[!#1][CH2][CH2]S(=O)(=O)[CH2][CH2][!#1]	PADEL_KR454
PADEL_KR455	[!#1][CH2][CH2]S(=O)(=O)[CH2][CH2]C(=O)[NH2]	PADEL_KR455
PADEL_KR456	[!#1][CH2][CH2]S(=O)(=O)O[!#1]	PADEL_KR456
PADEL_KR457	[!#1][CH2][CH2]S(=O)[!#1]	PADEL_KR457
PADEL_KR458	[!#1][CH2][CH2]S[!#1]	PADEL_KR458
PADEL_KR459	[!#1][CH2][CH2]S[CH2][!#1]	PADEL_KR459
PADEL_KR460	[!#1][CH2][CH2]S[CH2][CH2][!#1]	PADEL_KR460
PADEL_KR461	[!#1][CH2][CH2]S[CH2][CH2]S[CH2][CH2][!#1]	PADEL_KR461
PADEL_KR462	[!#1][CH2][CH2]S[CH2]C(=O)[OH]	PADEL_KR462
PADEL_KR463	[!#1][CH2][CH2]SC(=[NH])[NH2]	PADEL_KR463
PADEL_KR464	[!#1][CH2][CH2]SC(=O)[CH3]	PADEL_KR464
PADEL_KR465	[!#1][CH2][CH2]SC(=S)[!#1]	PADEL_KR465
PADEL_KR466	[!#1][CH2][CH3]	PADEL_KR466
PADEL_KR467	[!#1][CH2][NH][!#1]	PADEL_KR467
PADEL_KR468	[!#1][CH2][NH][CH]([CH2][!#1])C(=O)[OH]	PADEL_KR468
PADEL_KR469	[!#1][CH2][NH][CH]([CH3])[CH2][CH3]	PADEL_KR469
PADEL_KR470	[!#1][CH2][NH][CH]([CH3])[CH3]	PADEL_KR470
PADEL_KR471	[!#1][CH2][NH][CH]([NH]C(=O)[!#1])C(Br)(Br)Br	PADEL_KR471
PADEL_KR472	[!#1][CH2][NH][CH]([NH]C(=O)[!#1])C(Cl)(Cl)Cl	PADEL_KR472
PADEL_KR473	[!#1][CH2][NH][CH]=C1C(=O)[CH2][NH]C1=O	PADEL_KR473
PADEL_KR474	[!#1][CH2][NH][CH]=C1C(=O)[NH]C(=O)[NH]C1=O	PADEL_KR474
PADEL_KR475	[!#1][CH2][NH][CH]=C1C(=O)[NH]C(=O)N([!#1])C1=O	PADEL_KR475
PADEL_KR476	[!#1][CH2][NH][CH2][!#1]	PADEL_KR476
PADEL_KR477	[!#1][CH2][NH]C([CH3])([CH3])[CH3]	PADEL_KR477
PADEL_KR478	[!#1][CH2][NH]C(=[NH])[NH]C(=[NH])[NH2]	PADEL_KR478
PADEL_KR479	[!#1][CH2][NH]C(=N[OH])[!#1]	PADEL_KR479
PADEL_KR480	[!#1][CH2][NH]C(=O)[!#1]	PADEL_KR480
PADEL_KR481	[!#1][CH2][NH]C(=O)[CH]([!#1])[CH2][!#1]	PADEL_KR481
PADEL_KR482	[!#1][CH2][NH]C(=O)[CH]=[CH]C(=O)[OH]	PADEL_KR482
PADEL_KR483	[!#1][CH2][NH]C(=O)[CH2][!#1]	PADEL_KR483
PADEL_KR484	[!#1][CH2][NH]C(=O)[CH2][CH2]C(=O)[OH]	PADEL_KR484
PADEL_KR485	[!#1][CH2][NH]C(=O)[CH2]Cl	PADEL_KR485
PADEL_KR486	[!#1][CH2][NH]C(=O)[CH2]O[!#1]	PADEL_KR486
PADEL_KR487	[!#1][CH2][NH]C(=O)[CH3]	PADEL_KR487
PADEL_KR488	[!#1][CH2][NH]C(=O)[NH][!#1]	PADEL_KR488
PADEL_KR489	[!#1][CH2][NH]C(=O)C(=[CH][!#1])[NH]C(=O)[!#1]	PADEL_KR489
PADEL_KR490	[!#1][CH2][NH]C(=S)[NH][!#1]	PADEL_KR490
PADEL_KR491	[!#1][CH2][NH]C(=S)[NH]C(=O)[!#1]	PADEL_KR491
PADEL_KR492	[!#1][CH2][NH]S(=O)(=O)[!#1]	PADEL_KR492
PADEL_KR493	[!#1][CH2][NH2]	PADEL_KR493
PADEL_KR494	[!#1][CH2][OH]	PADEL_KR494
PADEL_KR495	[!#1][CH2]Br	PADEL_KR495
PADEL_KR496	[!#1][CH2]C#C[!#1]	PADEL_KR496
PADEL_KR497	[!#1][CH2]C([CH3])([CH3])[CH3]	PADEL_KR497
PADEL_KR498	[!#1][CH2]C(=[CH2])[CH3]	PADEL_KR498
PADEL_KR499	[!#1][CH2]C(=N[NH][!#1])[CH3]	PADEL_KR499
PADEL_KR500	[!#1][CH2]C(=N[NH]C(=O)[!#1])[CH3]	PADEL_KR500
PADEL_KR501	[!#1][CH2]C(=N[NH]C(=O)[!#1])C(=O)[OH]	PADEL_KR501
PADEL_KR502	[!#1][CH2]C(=N[NH]C(=O)[CH2]O[!#1])[CH3]	PADEL_KR502
PADEL_KR503	[!#1][CH2]C(=N[OH])[!#1]	PADEL_KR503
PADEL_KR504	[!#1][CH2]C(=O)[!#1]	PADEL_KR504
PADEL_KR505	[!#1][CH2]C(=O)[CH3]	PADEL_KR505
PADEL_KR506	[!#1][CH2]C(=O)[NH][!#1]	PADEL_KR506
PADEL_KR507	[!#1][CH2]C(=O)[NH][CH]([!#1])[CH3]	PADEL_KR507
PADEL_KR508	[!#1][CH2]C(=O)[NH][CH]([!#1])C(=O)[NH][!#1]	PADEL_KR508
PADEL_KR509	[!#1][CH2]C(=O)[NH][CH]([!#1])C(Cl)(Cl)Cl	PADEL_KR509
PADEL_KR510	[!#1][CH2]C(=O)[NH][CH]([NH][!#1])C(Cl)(Cl)Cl	PADEL_KR510
PADEL_KR511	[!#1][CH2]C(=O)[NH][CH]([NH]C(=S)[NH][!#1])C(Cl)(Cl)Cl	PADEL_KR511
PADEL_KR512	[!#1][CH2]C(=O)[NH][CH](S[!#1])C(Cl)(Cl)Cl	PADEL_KR512
PADEL_KR513	[!#1][CH2]C(=O)[NH][CH2][CH2][OH]	PADEL_KR513
PADEL_KR514	[!#1][CH2]C(=O)[NH][CH2][CH2]S(=O)(=O)[OH]	PADEL_KR514
PADEL_KR515	[!#1][CH2]C(=O)[NH][NH][!#1]	PADEL_KR515
PADEL_KR516	[!#1][CH2]C(=O)[NH][NH]C(=O)[!#1]	PADEL_KR516
PADEL_KR517	[!#1][CH2]C(=O)[NH][NH2]	PADEL_KR517
PADEL_KR518	[!#1][CH2]C(=O)[NH][OH]	PADEL_KR518
PADEL_KR519	[!#1][CH2]C(=O)[NH]N([!#1])[CH3]	PADEL_KR519
PADEL_KR520	[!#1][CH2]C(=O)[NH]N=[CH][!#1]	PADEL_KR520
PADEL_KR521	[!#1][CH2]C(=O)[NH]N=[CH][CH]([!#1])[!#1]	PADEL_KR521
PADEL_KR522	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH][cH][cH][cH][cH]1	PADEL_KR522
PADEL_KR523	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH][cH][cH][cH]c1[N+](=O)[O-]	PADEL_KR523
PADEL_KR524	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH][cH][cH][cH]c1[OH]	PADEL_KR524
PADEL_KR525	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH][cH][cH][cH]c1Br	PADEL_KR525
PADEL_KR526	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH][cH][cH][cH]c1Cl	PADEL_KR526
PADEL_KR527	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH][cH][cH]c([cH]1)[N+](=O)[O-]	PADEL_KR527
PADEL_KR528	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH][cH][cH]c(I)[cH]1	PADEL_KR528
PADEL_KR529	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH][cH][cH]o1	PADEL_KR529
PADEL_KR530	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH][cH][cH]s1	PADEL_KR530
PADEL_KR531	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH][cH]c([cH][cH]1)[N+](=O)[O-]	PADEL_KR531
PADEL_KR532	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH][cH]c([OH])[cH]c1[OH]	PADEL_KR532
PADEL_KR533	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH][cH]c(Br)[cH][cH]1	PADEL_KR533
PADEL_KR534	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH][cH]c(Cl)[cH][cH]1	PADEL_KR534
PADEL_KR535	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH][cH]c2O[CH2]Oc2[cH]1	PADEL_KR535
PADEL_KR536	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH][nH]c2[cH][cH][cH][cH]c12	PADEL_KR536
PADEL_KR537	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH]c([cH][cH]c1[OH])[N+](=O)[O-]	PADEL_KR537
PADEL_KR538	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH]c(N=Nc2[cH][cH][cH][cH][cH]2)[cH][cH]c1[OH]	PADEL_KR538
PADEL_KR539	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH]c2[cH][cH][cH][cH]c2nc1Cl	PADEL_KR539
PADEL_KR540	[!#1][CH2]C(=O)[NH]N=[CH]c1[cH]c2O[CH2]Oc2[cH]c1[N+](=O)[O-]	PADEL_KR540
PADEL_KR541	[!#1][CH2]C(=O)[NH]N=[CH]c1c([OH])[cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR541
PADEL_KR542	[!#1][CH2]C(=O)[NH]N=[CH]c1c(Cl)[cH][cH][cH]c1Cl	PADEL_KR542
PADEL_KR543	[!#1][CH2]C(=O)[NH]N=C([!#1])[CH3]	PADEL_KR543
PADEL_KR544	[!#1][CH2]C(=O)[NH]N=C([CH3])c1[cH][cH]c(Br)[cH][cH]1	PADEL_KR544
PADEL_KR545	[!#1][CH2]C(=O)[NH]N=C1[CH2][CH2][CH2]c2c1non2=O	PADEL_KR545
PADEL_KR546	[!#1][CH2]C(=O)[NH]S(=O)(=O)[!#1]	PADEL_KR546
PADEL_KR547	[!#1][CH2]C(=O)[NH2]	PADEL_KR547
PADEL_KR548	[!#1][CH2]C(=O)[OH]	PADEL_KR548
PADEL_KR549	[!#1][CH2]C(=O)C([CH3])([CH3])[CH3]	PADEL_KR549
PADEL_KR550	[!#1][CH2]C(=O)c1[cH][cH][cH][cH][cH]1	PADEL_KR550
PADEL_KR551	[!#1][CH2]C(=O)c1[cH][cH]c([!#1])[cH][cH]1	PADEL_KR551
PADEL_KR552	[!#1][CH2]C(=O)c1[cH][cH]c([CH3])[cH][cH]1	PADEL_KR552
PADEL_KR553	[!#1][CH2]C(=O)c1[cH][cH]c(Cl)c(Cl)[cH]1	PADEL_KR553
PADEL_KR554	[!#1][CH2]C(=O)N([!#1])[CH3]	PADEL_KR554
PADEL_KR555	[!#1][CH2]C(=O)N([CH3])[CH]([!#1])C(=O)[NH][!#1]	PADEL_KR555
PADEL_KR556	[!#1][CH2]C(=O)N=[CH][NH][NH][!#1]	PADEL_KR556
PADEL_KR557	[!#1][CH2]C(=O)O[!#1]	PADEL_KR557
PADEL_KR558	[!#1][CH2]C(=O)O[CH2][CH2][CH2][CH3]	PADEL_KR558
PADEL_KR559	[!#1][CH2]C(=O)O[CH2][CH2][NH]C(=O)[!#1]	PADEL_KR559
PADEL_KR560	[!#1][CH2]C(=O)O[CH2][CH3]	PADEL_KR560
PADEL_KR561	[!#1][CH2]C(=O)O[CH2]C(=O)[!#1]	PADEL_KR561
PADEL_KR562	[!#1][CH2]C(=O)O[CH3]	PADEL_KR562
PADEL_KR563	[!#1][CH2]C(=O)O[Na]	PADEL_KR563
PADEL_KR564	[!#1][CH2]C(=S)[!#1]	PADEL_KR564
PADEL_KR565	[!#1][CH2]C1([CH2][CH]2[CH2][CH]3[CH2][CH]([CH2]2)[CH2]1)[CH2]3	PADEL_KR565
PADEL_KR566	[!#1][CH2]c1[cH][cH][cH][cH][cH]1	PADEL_KR566
PADEL_KR567	[!#1][CH2]c1[cH][cH][cH][cH]c1Br	PADEL_KR567
PADEL_KR568	[!#1][CH2]c1[cH][cH][cH][cH]c1C(F)(F)F	PADEL_KR568
PADEL_KR569	[!#1][CH2]c1[cH][cH][cH][cH]c1Cl	PADEL_KR569
PADEL_KR570	[!#1][CH2]c1[cH][cH][cH][cH]c1F	PADEL_KR570
PADEL_KR571	[!#1][CH2]c1[cH][cH][cH]c([CH3])[cH]1	PADEL_KR571
PADEL_KR572	[!#1][CH2]c1[cH][cH][cH]c([OH])[cH]1	PADEL_KR572
PADEL_KR573	[!#1][CH2]c1[cH][cH][cH]c(Br)[cH]1	PADEL_KR573
PADEL_KR574	[!#1][CH2]c1[cH][cH][cH]c(Cl)[cH]1	PADEL_KR574
PADEL_KR575	[!#1][CH2]c1[cH][cH][cH]c(Cl)c1Cl	PADEL_KR575
PADEL_KR576	[!#1][CH2]c1[cH][cH][cH]c(F)[cH]1	PADEL_KR576
PADEL_KR577	[!#1][CH2]c1[cH][cH][cH]c(O[!#1])[cH]1	PADEL_KR577
PADEL_KR578	[!#1][CH2]c1[cH][cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR578
PADEL_KR579	[!#1][CH2]c1[cH][cH][cH]n[cH]1	PADEL_KR579
PADEL_KR580	[!#1][CH2]c1[cH][cH][cH]o1	PADEL_KR580
PADEL_KR581	[!#1][CH2]c1[cH][cH][cH]s1	PADEL_KR581
PADEL_KR582	[!#1][CH2]c1[cH][cH]c([!#1])[cH][cH]1	PADEL_KR582
PADEL_KR583	[!#1][CH2]c1[cH][cH]c([cH][cH]1)[N+](=O)[O-]	PADEL_KR583
PADEL_KR584	[!#1][CH2]c1[cH][cH]c([cH][cH]1)C(F)(F)F	PADEL_KR584
PADEL_KR585	[!#1][CH2]c1[cH][cH]c([CH3])[cH][cH]1	PADEL_KR585
PADEL_KR586	[!#1][CH2]c1[cH][cH]c(Br)[cH][cH]1	PADEL_KR586
PADEL_KR587	[!#1][CH2]c1[cH][cH]c(Br)s1	PADEL_KR587
PADEL_KR588	[!#1][CH2]c1[cH][cH]c(Cl)[cH][cH]1	PADEL_KR588
PADEL_KR589	[!#1][CH2]c1[cH][cH]c(Cl)[cH]c1Cl	PADEL_KR589
PADEL_KR590	[!#1][CH2]c1[cH][cH]c(F)[cH][cH]1	PADEL_KR590
PADEL_KR591	[!#1][CH2]c1[cH][cH]c(F)[cH]c1F	PADEL_KR591
PADEL_KR592	[!#1][CH2]c1[cH][cH]c(O[!#1])[cH][cH]1	PADEL_KR592
PADEL_KR593	[!#1][CH2]c1[cH][cH]c(O[!#1])c(O[!#1])[cH]1	PADEL_KR593
PADEL_KR594	[!#1][CH2]c1[cH][cH]c(S[CH3])[cH][cH]1	PADEL_KR594
PADEL_KR595	[!#1][CH2]c1[cH][cH]c2[cH][cH][cH][cH]c2[cH]1	PADEL_KR595
PADEL_KR596	[!#1][CH2]c1[cH][cH]c2O[CH2]Oc2[cH]1	PADEL_KR596
PADEL_KR597	[!#1][CH2]c1[cH][cH]o[cH]1	PADEL_KR597
PADEL_KR598	[!#1][CH2]c1[cH][cH]s[cH]1	PADEL_KR598
PADEL_KR599	[!#1][CH2]c1[cH][nH]c2[cH][cH][cH][cH]c12	PADEL_KR599
PADEL_KR600	[!#1][CH2]c1[cH]c([CH2][!#1])c([OH])c([!#1])n1	PADEL_KR600
PADEL_KR601	[!#1][CH2]c1c([!#1])[cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR601
PADEL_KR602	[!#1][CH2]c1c([NH][!#1])sc2[CH2][CH2][CH2][CH2]c12	PADEL_KR602
PADEL_KR603	[!#1][CH2]c1nc2[cH][cH][cH][cH]c2[nH]1	PADEL_KR603
PADEL_KR604	[!#1][CH2]Cl	PADEL_KR604
PADEL_KR605	[!#1][CH2]N([!#1])[CH2][!#1]	PADEL_KR605
PADEL_KR606	[!#1][CH2]N([!#1])[CH2][CH2][OH]	PADEL_KR606
PADEL_KR607	[!#1][CH2]N([!#1])[CH2][CH3]	PADEL_KR607
PADEL_KR608	[!#1][CH2]N([!#1])[CH3]	PADEL_KR608
PADEL_KR609	[!#1][CH2]N([!#1])[NH]C(=O)[CH2][!#1]	PADEL_KR609
PADEL_KR610	[!#1][CH2]N([!#1])C(=O)[!#1]	PADEL_KR610
PADEL_KR611	[!#1][CH2]N([!#1])C(=O)[CH2][CH2]C(=O)[!#1]	PADEL_KR611
PADEL_KR612	[!#1][CH2]N([!#1])C(=O)[CH2]O[!#1]	PADEL_KR612
PADEL_KR613	[!#1][CH2]N([!#1])C(=O)[CH3]	PADEL_KR613
PADEL_KR614	[!#1][CH2]N([!#1])C(=O)c1[cH][cH][cH][cH]c1C(=O)[!#1]	PADEL_KR614
PADEL_KR615	[!#1][CH2]N([!#1])C(=O)c1[cH]c([cH][cH]c1C(=O)[!#1])[N+](=O)[O-]	PADEL_KR615
PADEL_KR616	[!#1][CH2]N([!#1])C(=O)c1[cH]c(Br)[cH][cH]c1C(=O)[!#1]	PADEL_KR616
PADEL_KR617	[!#1][CH2]N([!#1])c1[cH][cH][cH][cH]c1C(=O)C(=O)[!#1]	PADEL_KR617
PADEL_KR618	[!#1][CH2]N([!#1])N=[CH][!#1]	PADEL_KR618
PADEL_KR619	[!#1][CH2]N([!#1])S(=O)(=O)[NH]C(=O)[NH][!#1]	PADEL_KR619
PADEL_KR620	[!#1][CH2]N([CH2][!#1])[CH2][!#1]	PADEL_KR620
PADEL_KR621	[!#1][CH2]N([CH2][!#1])C(=O)[!#1]	PADEL_KR621
PADEL_KR622	[!#1][CH2]N([CH2][!#1])C(=O)[NH][!#1]	PADEL_KR622
PADEL_KR623	[!#1][CH2]N([CH2][!#1])S(=O)(=O)[!#1]	PADEL_KR623
PADEL_KR624	[!#1][CH2]N([CH2][CH]([OH])[CH2]O[!#1])C([CH3])([CH3])[CH3]	PADEL_KR624
PADEL_KR625	[!#1][CH2]N([CH2][CH]=[CH2])[CH2][CH]=[CH2]	PADEL_KR625
PADEL_KR626	[!#1][CH2]N([CH2][CH2][OH])[CH2][CH2][OH]	PADEL_KR626
PADEL_KR627	[!#1][CH2]N([CH2][CH3])[CH2][CH3]	PADEL_KR627
PADEL_KR628	[!#1][CH2]N([CH2]C(=O)[OH])[CH2]C(=O)[OH]	PADEL_KR628
PADEL_KR629	[!#1][CH2]N([CH3])[CH3]	PADEL_KR629
PADEL_KR630	[!#1][CH2]N([CH3])C(=O)[!#1]	PADEL_KR630
PADEL_KR631	[!#1][CH2]N([CH3])S(=O)(=O)[!#1]	PADEL_KR631
PADEL_KR632	[!#1][CH2]N([OH])[CH2][!#1]	PADEL_KR632
PADEL_KR633	[!#1][CH2]N(C([CH3])([CH3])[CH3])S(=O)(=O)[!#1]	PADEL_KR633
PADEL_KR634	[!#1][CH2]N(C(=O)[!#1])C([CH3])([CH3])[CH3]	PADEL_KR634
PADEL_KR635	[!#1][CH2]N(C(=O)[CH2][CH2]C(=O)[OH])C([CH3])([CH3])[CH3]	PADEL_KR635
PADEL_KR636	[!#1][CH2]N=[CH][!#1]	PADEL_KR636
PADEL_KR637	[!#1][CH2]N=c1[cH][cH]n([!#1])[cH][cH]1	PADEL_KR637
PADEL_KR638	[!#1][CH2]N1[CH2][CH2][CH]([!#1])[CH2][CH2]1	PADEL_KR638
PADEL_KR639	[!#1][CH2]N1[CH2][CH2][CH2][CH2][CH2]1	PADEL_KR639
PADEL_KR640	[!#1][CH2]N1[CH2][CH2]N([CH2][CH2]1)c2[cH][cH][cH][cH][cH]2	PADEL_KR640
PADEL_KR641	[!#1][CH2]N1[CH2][CH2]N([CH2][CH2]1)c2[cH][cH][cH][cH]n2	PADEL_KR641
PADEL_KR642	[!#1][CH2]N1[CH2][CH2]N([CH2][CH2]1)c2[cH][cH]c(Cl)[cH][cH]2	PADEL_KR642
PADEL_KR643	[!#1][CH2]N1[CH2][CH2]N([CH2][CH2]1)c2[cH][cH]c(F)[cH][cH]2	PADEL_KR643
PADEL_KR644	[!#1][CH2]N1[CH2][CH2]O[CH2][CH2]1	PADEL_KR644
PADEL_KR645	[!#1][CH2]N1C(=O)c2[cH][cH][cH][cH]c2C1=O	PADEL_KR645
PADEL_KR646	[!#1][CH2]n1nnc2[cH][cH][cH][cH]c12	PADEL_KR646
PADEL_KR647	[!#1][CH2]O[!#1]	PADEL_KR647
PADEL_KR648	[!#1][CH2]O[CH2][!#1]	PADEL_KR648
PADEL_KR649	[!#1][CH2]O[CH2][CH]([OH])[CH2][!#1]	PADEL_KR649
PADEL_KR650	[!#1][CH2]O[CH2][CH]([OH])[CH2][NH][CH]([CH3])[CH3]	PADEL_KR650
PADEL_KR651	[!#1][CH2]O[CH2][CH3]	PADEL_KR651
PADEL_KR652	[!#1][CH2]O[CH3]	PADEL_KR652
PADEL_KR653	[!#1][CH2]OC([!#1])([!#1])[!#1]	PADEL_KR653
PADEL_KR654	[!#1][CH2]OC(=O)[!#1]	PADEL_KR654
PADEL_KR655	[!#1][CH2]OC(=O)[CH]([CH]([!#1])S[CH2][!#1])[N+](=O)[O-]	PADEL_KR655
PADEL_KR656	[!#1][CH2]OC(=O)[CH2][CH2]C(=O)[OH]	PADEL_KR656
PADEL_KR657	[!#1][CH2]OC(=O)[CH2][CH3]	PADEL_KR657
PADEL_KR658	[!#1][CH2]OC(=O)[CH3]	PADEL_KR658
PADEL_KR659	[!#1][CH2]OC(=O)[NH][!#1]	PADEL_KR659
PADEL_KR660	[!#1][CH2]OC(=O)[NH][CH]([NH]C(=S)[NH][!#1])C(Cl)(Cl)Cl	PADEL_KR660
PADEL_KR661	[!#1][CH2]OP(=S)(O[CH2][CH3])O[CH2][CH3]	PADEL_KR661
PADEL_KR662	[!#1][CH2]OS(=O)(=O)[!#1]	PADEL_KR662
PADEL_KR663	[!#1][CH2]S(=O)(=O)[!#1]	PADEL_KR663
PADEL_KR664	[!#1][CH2]S(=O)(=O)[NH][!#1]	PADEL_KR664
PADEL_KR665	[!#1][CH2]S[!#1]	PADEL_KR665
PADEL_KR666	[!#1][CH2]S[CH2]C(=O)[NH]N=[CH][!#1]	PADEL_KR666
PADEL_KR667	[!#1][CH2]S[CH2]S[CH2][!#1]	PADEL_KR667
PADEL_KR668	[!#1][CH2]SC(=[NH])[NH2]	PADEL_KR668
PADEL_KR669	[!#1][CH3]	PADEL_KR669
PADEL_KR670	[!#1][N]([CH3])([CH3])[CH3]	PADEL_KR670
PADEL_KR671	[!#1][N+]([CH3])([CH3])[CH3]	PADEL_KR671
PADEL_KR672	[!#1][N+](=O)[O-]	PADEL_KR672
PADEL_KR673	[!#1][n+]1[cH][cH][cH][cH][cH]1	PADEL_KR673
PADEL_KR674	[!#1][n+]1[cH][cH]c2[cH][cH][cH][cH]c2[cH]1	PADEL_KR674
PADEL_KR675	[!#1][n+]1c([CH3])sc2[cH][cH]c(O[CH3])[cH]c12	PADEL_KR675
PADEL_KR676	[!#1][NH](=O)[OH]	PADEL_KR676
PADEL_KR677	[!#1][NH][!#1]	PADEL_KR677
PADEL_KR678	[!#1][NH][CH]([!#1])[!#1]	PADEL_KR678
PADEL_KR679	[!#1][NH][CH]([!#1])[CH]([CH3])[CH3]	PADEL_KR679
PADEL_KR680	[!#1][NH][CH]([!#1])[CH2][CH]([!#1])[CH3]	PADEL_KR680
PADEL_KR681	[!#1][NH][CH]([!#1])[CH2][CH2][CH3]	PADEL_KR681
PADEL_KR682	[!#1][NH][CH]([!#1])[CH2]C(=O)[!#1]	PADEL_KR682
PADEL_KR683	[!#1][NH][CH]([!#1])[CH3]	PADEL_KR683
PADEL_KR684	[!#1][NH][CH]([!#1])C(Br)(Br)Br	PADEL_KR684
PADEL_KR685	[!#1][NH][CH]([!#1])C(Cl)(Cl)Cl	PADEL_KR685
PADEL_KR686	[!#1][NH][CH]([!#1])P(=O)(O[CH]([CH3])[CH3])O[CH]([CH3])[CH3]	PADEL_KR686
PADEL_KR687	[!#1][NH][CH]([!#1])P(=O)(O[CH2][CH3])O[CH2][CH3]	PADEL_KR687
PADEL_KR688	[!#1][NH][CH]([!#1])P(=O)(O[CH3])O[CH3]	PADEL_KR688
PADEL_KR689	[!#1][NH][CH]([CH]([CH3])[CH3])C(=O)[OH]	PADEL_KR689
PADEL_KR690	[!#1][NH][CH]([CH2][CH]([CH3])[CH3])C(=O)[!#1]	PADEL_KR690
PADEL_KR691	[!#1][NH][CH]([CH2][CH]([CH3])[CH3])C(=O)[OH]	PADEL_KR691
PADEL_KR692	[!#1][NH][CH]([CH2][CH2][OH])C(=O)[NH][!#1]	PADEL_KR692
PADEL_KR693	[!#1][NH][CH]([CH2][CH2]S[CH3])C(=O)[OH]	PADEL_KR693
PADEL_KR694	[!#1][NH][CH]([CH2][CH3])C(=O)[OH]	PADEL_KR694
PADEL_KR695	[!#1][NH][CH]([CH2]C([!#1])([CH3])[CH3])[CH2]C([CH3])([CH3])[NH][!#1]	PADEL_KR695
PADEL_KR696	[!#1][NH][CH]([CH2]C(=O)[OH])c1[cH][cH][cH][cH][cH]1	PADEL_KR696
PADEL_KR697	[!#1][NH][CH]([CH2]c1[cH][cH][cH][cH][cH]1)C(=O)[!#1]	PADEL_KR697
PADEL_KR698	[!#1][NH][CH]([CH2]c1[cH][cH][cH][cH][cH]1)C(=O)[OH]	PADEL_KR698
PADEL_KR699	[!#1][NH][CH]([CH2]c1[cH][cH]c([OH])[cH][cH]1)C(=O)[!#1]	PADEL_KR699
PADEL_KR700	[!#1][NH][CH]([CH2]c1[cH][nH]c2[cH][cH][cH][cH]c12)C(=O)[!#1]	PADEL_KR700
PADEL_KR701	[!#1][NH][CH]([CH2]c1[cH][nH]c2[cH][cH][cH][cH]c12)C(=O)[OH]	PADEL_KR701
PADEL_KR702	[!#1][NH][CH]([CH3])[CH2][CH2][CH2]N([CH2][CH3])[CH2][CH3]	PADEL_KR702
PADEL_KR703	[!#1][NH][CH]([CH3])[CH2][CH3]	PADEL_KR703
PADEL_KR704	[!#1][NH][CH]([CH3])[CH2]c1[cH][cH][cH][cH][cH]1	PADEL_KR704
PADEL_KR705	[!#1][NH][CH]([CH3])[CH2]c1[cH][nH]c2[cH][cH][cH][cH]c12	PADEL_KR705
PADEL_KR706	[!#1][NH][CH]([CH3])[CH3]	PADEL_KR706
PADEL_KR707	[!#1][NH][CH]([CH3])C(=O)[!#1]	PADEL_KR707
PADEL_KR708	[!#1][NH][CH]([CH3])c1[cH][cH][cH][cH][cH]1	PADEL_KR708
PADEL_KR709	[!#1][NH][CH]([NH]C(=O)[!#1])C(=O)[!#1]	PADEL_KR709
PADEL_KR710	[!#1][NH][CH]([NH]C(=O)[!#1])C(Br)(Br)Br	PADEL_KR710
PADEL_KR711	[!#1][NH][CH]([NH]C(=O)[!#1])C(Cl)(Cl)Cl	PADEL_KR711
PADEL_KR712	[!#1][NH][CH]([NH]C(=O)[CH]([CH3])[CH3])C(Cl)(Cl)Cl	PADEL_KR712
PADEL_KR713	[!#1][NH][CH]([NH]C(=O)[CH2][CH2][CH2][CH2][CH2][CH3])C(Cl)(Cl)Cl	PADEL_KR713
PADEL_KR714	[!#1][NH][CH]([NH]C(=O)[CH2][CH2][CH3])C(Cl)(Cl)Cl	PADEL_KR714
PADEL_KR715	[!#1][NH][CH]([NH]C(=O)[CH2][CH3])C(Cl)(Cl)Cl	PADEL_KR715
PADEL_KR716	[!#1][NH][CH]([NH]C(=O)[CH2]F)C(Cl)(Cl)Cl	PADEL_KR716
PADEL_KR717	[!#1][NH][CH]([NH]C(=O)[NH][!#1])C(Cl)(Cl)Cl	PADEL_KR717
PADEL_KR718	[!#1][NH][CH]([NH]C(=O)[NH][CH]([NH][!#1])C(Cl)(Cl)Cl)C(Cl)(Cl)Cl	PADEL_KR718
PADEL_KR719	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH][cH][cH][cH]1)C(Cl)(Cl)Cl	PADEL_KR719
PADEL_KR720	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH][cH][cH]c1[CH3])C(Cl)(Cl)Cl	PADEL_KR720
PADEL_KR721	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH][cH][cH]c1[N+](=O)[O-])C(Cl)(Cl)Cl	PADEL_KR721
PADEL_KR722	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH][cH][cH]c1[OH])C(Cl)(Cl)Cl	PADEL_KR722
PADEL_KR723	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH][cH][cH]c1C(=O)[!#1])C(Cl)(Cl)Cl	PADEL_KR723
PADEL_KR724	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH][cH][cH]c1C(=O)[OH])C(Cl)(Cl)Cl	PADEL_KR724
PADEL_KR725	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH][cH][cH]c1O[!#1])C(Cl)(Cl)Cl	PADEL_KR725
PADEL_KR726	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH][cH]c([cH]1)[N+](=O)[O-])C(Cl)(Cl)Cl	PADEL_KR726
PADEL_KR727	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH][cH]c([cH]1)C(=O)[OH])C(Cl)(Cl)Cl	PADEL_KR727
PADEL_KR728	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH][cH]c([CH3])[cH]1)C(Cl)(Cl)Cl	PADEL_KR728
PADEL_KR729	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH][cH]c([OH])[cH]1)C(Cl)(Cl)Cl	PADEL_KR729
PADEL_KR730	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH][cH]c2[cH][cH][cH][cH]c12)C(Cl)(Cl)Cl	PADEL_KR730
PADEL_KR731	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH][cH]c2[cH][cH][cH]nc12)C(Cl)(Cl)Cl	PADEL_KR731
PADEL_KR732	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH]c([cH][cH]1)[N+](=O)[O-])C(Cl)(Cl)Cl	PADEL_KR732
PADEL_KR733	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH]c([cH][cH]1)C(=O)[OH])C(Cl)(Cl)Cl	PADEL_KR733
PADEL_KR734	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH]c([cH][cH]1)S(=O)(=O)[!#1])C(Cl)(Cl)Cl	PADEL_KR734
PADEL_KR735	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH]c([CH3])[cH][cH]1)C(Cl)(Cl)Cl	PADEL_KR735
PADEL_KR736	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH]c([NH][!#1])[cH][cH]1)C(Cl)(Cl)Cl	PADEL_KR736
PADEL_KR737	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH]c(N=Nc2[cH][cH][cH][cH][cH]2)[cH][cH]1)C(Cl)(Cl)Cl	PADEL_KR737
PADEL_KR738	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH]c(N=Nc2[cH][cH][cH][cH]c2[CH3])[cH]c1[CH3])C(Cl)(Cl)Cl	PADEL_KR738
PADEL_KR739	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH]c(O[!#1])[cH][cH]1)C(Cl)(Cl)Cl	PADEL_KR739
PADEL_KR740	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH][cH]c(O[!#1])[cH]c1[N+](=O)[O-])C(Cl)(Cl)Cl	PADEL_KR740
PADEL_KR741	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH]c([cH][cH]c1Cl)C(F)(F)F)C(Cl)(Cl)Cl	PADEL_KR741
PADEL_KR742	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH]c([cH][cH]c1O[!#1])[N+](=O)[O-])C(Cl)(Cl)Cl	PADEL_KR742
PADEL_KR743	[!#1][NH][CH]([NH]C(=S)[NH]c1[cH]c(Cl)[cH][cH]c1Cl)C(Cl)(Cl)Cl	PADEL_KR743
PADEL_KR744	[!#1][NH][CH]([NH]C(=S)[NH]c1sc2[CH2][CH2][CH2][CH2]c2c1C(=O)[!#1])C(Cl)(Cl)Cl	PADEL_KR744
PADEL_KR745	[!#1][NH][CH](c1[cH][cH][cH][cH][cH]1)C([!#1])([!#1])C(=O)[!#1]	PADEL_KR745
PADEL_KR746	[!#1][NH][CH](c1[cH][cH][cH][cH][cH]1)c2c([OH])[cH][cH]c3[cH][cH][cH][cH]c23	PADEL_KR746
PADEL_KR747	[!#1][NH][CH](c1[cH][cH][cH][cH]c1[!#1])c2[cH][cH][cH][cH]c2O[!#1]	PADEL_KR747
PADEL_KR748	[!#1][NH][CH]=[CH][!#1]	PADEL_KR748
PADEL_KR749	[!#1][NH][CH]=C1C(=O)[CH2][NH]C1=O	PADEL_KR749
PADEL_KR750	[!#1][NH][CH]=C1C(=O)[CH2]C([!#1])([CH3])[CH]([!#1])C1=O	PADEL_KR750
PADEL_KR751	[!#1][NH][CH]=C1C(=O)[CH2]C([!#1])([CH3])[CH2]C1=O	PADEL_KR751
PADEL_KR752	[!#1][NH][CH]1[CH2][CH2][CH2][CH2][CH2]1	PADEL_KR752
PADEL_KR753	[!#1][NH][CH]1[CH2][CH2][CH2][CH2]1	PADEL_KR753
PADEL_KR754	[!#1][NH][CH]1[CH2][CH2]1	PADEL_KR754
PADEL_KR755	[!#1][NH][CH]1[CH2][CH2]S(=O)(=O)[CH2]1	PADEL_KR755
PADEL_KR756	[!#1][NH][CH]1O[CH]([CH2][OH])[CH]([OH])[CH]([OH])[CH]1[OH]	PADEL_KR756
PADEL_KR757	[!#1][NH][CH]1O[CH2][CH]([OH])[CH]([OH])[CH]1[OH]	PADEL_KR757
PADEL_KR758	[!#1][NH][CH2][CH]([!#1])[!#1]	PADEL_KR758
PADEL_KR759	[!#1][NH][CH2][CH]([CH3])[CH3]	PADEL_KR759
PADEL_KR760	[!#1][NH][CH2][CH]([OH])[CH]([OH])[CH]([OH])[CH2][OH]	PADEL_KR760
PADEL_KR761	[!#1][NH][CH2][CH]([OH])[CH2]O[!#1]	PADEL_KR761
PADEL_KR762	[!#1][NH][CH2][CH]=[CH2]	PADEL_KR762
PADEL_KR763	[!#1][NH][CH2][CH2][CH2][CH2][CH2][CH2][NH][!#1]	PADEL_KR763
PADEL_KR764	[!#1][NH][CH2][CH2][CH2][CH2][CH2][CH2][OH]	PADEL_KR764
PADEL_KR765	[!#1][NH][CH2][CH2][CH2][CH2][CH2]C(=O)[OH]	PADEL_KR765
PADEL_KR766	[!#1][NH][CH2][CH2][CH2][CH2][CH3]	PADEL_KR766
PADEL_KR767	[!#1][NH][CH2][CH2][CH2][CH2][OH]	PADEL_KR767
PADEL_KR768	[!#1][NH][CH2][CH2][CH2][CH3]	PADEL_KR768
PADEL_KR769	[!#1][NH][CH2][CH2][CH2][NH2]	PADEL_KR769
PADEL_KR770	[!#1][NH][CH2][CH2][CH2][OH]	PADEL_KR770
PADEL_KR771	[!#1][NH][CH2][CH2][CH2]C(=O)[OH]	PADEL_KR771
PADEL_KR772	[!#1][NH][CH2][CH2][CH2]O[CH3]	PADEL_KR772
PADEL_KR773	[!#1][NH][CH2][CH2][CH3]	PADEL_KR773
PADEL_KR774	[!#1][NH][CH2][CH2][NH][!#1]	PADEL_KR774
PADEL_KR775	[!#1][NH][CH2][CH2][NH2]	PADEL_KR775
PADEL_KR776	[!#1][NH][CH2][CH2][OH]	PADEL_KR776
PADEL_KR777	[!#1][NH][CH2][CH2]C#N	PADEL_KR777
PADEL_KR778	[!#1][NH][CH2][CH2]C(=O)[!#1]	PADEL_KR778
PADEL_KR779	[!#1][NH][CH2][CH2]C(=O)[OH]	PADEL_KR779
PADEL_KR780	[!#1][NH][CH2][CH2]c1[cH][cH][cH][cH][cH]1	PADEL_KR780
PADEL_KR781	[!#1][NH][CH2][CH2]c1[cH][cH]c(O[!#1])[cH][cH]1	PADEL_KR781
PADEL_KR782	[!#1][NH][CH2][CH2]c1[cH][cH]c(O[!#1])c(O[!#1])[cH]1	PADEL_KR782
PADEL_KR783	[!#1][NH][CH2][CH2]c1[cH][nH]c2[cH][cH][cH][cH]c12	PADEL_KR783
PADEL_KR784	[!#1][NH][CH2][CH2]c1[cH][nH]c2[cH][cH]c(O[!#1])[cH]c12	PADEL_KR784
PADEL_KR785	[!#1][NH][CH2][CH2]N([CH2][CH3])[CH2][CH3]	PADEL_KR785
PADEL_KR786	[!#1][NH][CH2][CH2]O[!#1]	PADEL_KR786
PADEL_KR787	[!#1][NH][CH2][CH2]S(=O)(=O)[OH]	PADEL_KR787
PADEL_KR788	[!#1][NH][CH2][CH3]	PADEL_KR788
PADEL_KR789	[!#1][NH][CH2][NH][!#1]	PADEL_KR789
PADEL_KR790	[!#1][NH][CH2]C(=O)[!#1]	PADEL_KR790
PADEL_KR791	[!#1][NH][CH2]C(=O)[NH][!#1]	PADEL_KR791
PADEL_KR792	[!#1][NH][CH2]C(=O)[NH]N=[CH][!#1]	PADEL_KR792
PADEL_KR793	[!#1][NH][CH2]C(=O)[NH]N=[CH]c1[cH][cH]c([OH])[cH][cH]1	PADEL_KR793
PADEL_KR794	[!#1][NH][CH2]C(=O)[NH]N=[CH]c1[cH][cH]c2O[CH2]Oc2[cH]1	PADEL_KR794
PADEL_KR795	[!#1][NH][CH2]C(=O)[NH]N=[CH]c1[cH]c(N=Nc2[cH][cH][cH][cH][cH]2)[cH][cH]c1[OH]	PADEL_KR795
PADEL_KR796	[!#1][NH][CH2]C(=O)[NH]N=[CH]c1[cH]c2[cH][cH][cH][cH]c2nc1Cl	PADEL_KR796
PADEL_KR797	[!#1][NH][CH2]C(=O)[OH]	PADEL_KR797
PADEL_KR798	[!#1][NH][CH2]C(=O)C([!#1])([!#1])C(=O)[!#1]	PADEL_KR798
PADEL_KR799	[!#1][NH][CH2]C(=O)O[CH2][CH2][CH2][CH3]	PADEL_KR799
PADEL_KR800	[!#1][NH][CH2]C(=O)O[CH2][CH3]	PADEL_KR800
PADEL_KR801	[!#1][NH][CH2]C(=O)O[CH3]	PADEL_KR801
PADEL_KR802	[!#1][NH][CH2]c1[cH][cH][cH][cH][cH]1	PADEL_KR802
PADEL_KR803	[!#1][NH][CH2]c1[cH][cH][cH]n[cH]1	PADEL_KR803
PADEL_KR804	[!#1][NH][CH2]c1[cH][cH][cH]o1	PADEL_KR804
PADEL_KR805	[!#1][NH][CH2]c1[cH][cH][cH]s1	PADEL_KR805
PADEL_KR806	[!#1][NH][CH2]c1[cH][cH]c(Cl)[cH][cH]1	PADEL_KR806
PADEL_KR807	[!#1][NH][CH2]c1[cH]c(Br)[cH]c(Br)c1O[!#1]	PADEL_KR807
PADEL_KR808	[!#1][NH][CH2]c1[cH]c(Br)[cH]c(C(=O)[OH])c1O[!#1]	PADEL_KR808
PADEL_KR809	[!#1][NH][CH2]c1c(O[!#1])[cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR809
PADEL_KR810	[!#1][NH][CH3]	PADEL_KR810
PADEL_KR811	[!#1][NH][NH][!#1]	PADEL_KR811
PADEL_KR812	[!#1][NH][NH][CH]=O	PADEL_KR812
PADEL_KR813	[!#1][NH][NH]C(=O)[!#1]	PADEL_KR813
PADEL_KR814	[!#1][NH][NH]C(=O)[CH2][CH2][CH3]	PADEL_KR814
PADEL_KR815	[!#1][NH][NH]C(=O)[CH3]	PADEL_KR815
PADEL_KR816	[!#1][NH][NH]C(=O)[NH][!#1]	PADEL_KR816
PADEL_KR817	[!#1][NH][NH]C(=S)[NH][!#1]	PADEL_KR817
PADEL_KR818	[!#1][NH][NH]C(=S)[NH2]	PADEL_KR818
PADEL_KR819	[!#1][NH][NH]S(=O)(=O)[!#1]	PADEL_KR819
PADEL_KR820	[!#1][NH][NH2]	PADEL_KR820
PADEL_KR821	[!#1][NH]C([!#1])([!#1])[!#1]	PADEL_KR821
PADEL_KR822	[!#1][NH]C([!#1])([!#1])[CH3]	PADEL_KR822
PADEL_KR823	[!#1][NH]C([!#1])([!#1])C(=O)[!#1]	PADEL_KR823
PADEL_KR824	[!#1][NH]C([!#1])([!#1])C(=O)c1[cH][cH][cH][cH]c1C(=O)[CH]([!#1])[!#1]	PADEL_KR824
PADEL_KR825	[!#1][NH]C([!#1])([CH3])[CH2][CH3]	PADEL_KR825
PADEL_KR826	[!#1][NH]C([!#1])([CH3])[CH3]	PADEL_KR826
PADEL_KR827	[!#1][NH]C([CH3])([CH3])[CH2][CH]([!#1])[CH2]C([!#1])([CH3])[CH3]	PADEL_KR827
PADEL_KR828	[!#1][NH]C([CH3])([CH3])[CH2][OH]	PADEL_KR828
PADEL_KR829	[!#1][NH]C([CH3])([CH3])[CH3]	PADEL_KR829
PADEL_KR830	[!#1][NH]C(=[NH])[NH]C(=[NH])[NH][!#1]	PADEL_KR830
PADEL_KR831	[!#1][NH]C(=[NH])[NH]C(=[NH])N([CH3])[CH3]	PADEL_KR831
PADEL_KR832	[!#1][NH]C(=[NH])[NH]C(=O)[NH2]	PADEL_KR832
PADEL_KR833	[!#1][NH]C(=[NH])[NH2]	PADEL_KR833
PADEL_KR834	[!#1][NH]C(=C(S(=O)(=O)[CH2][CH3])S(=O)(=O)[CH2][CH3])[NH][!#1]	PADEL_KR834
PADEL_KR835	[!#1][NH]C(=C1C(=O)[CH2]SC1=O)[CH3]	PADEL_KR835
PADEL_KR836	[!#1][NH]C(=C1C(=O)[NH]C(=O)N([!#1])C1=O)[CH3]	PADEL_KR836
PADEL_KR837	[!#1][NH]C(=N[!#1])[NH][!#1]	PADEL_KR837
PADEL_KR838	[!#1][NH]C(=N[!#1])SC([!#1])([!#1])C(=O)[!#1]	PADEL_KR838
PADEL_KR839	[!#1][NH]C(=O)[!#1]	PADEL_KR839
PADEL_KR840	[!#1][NH]C(=O)[CH]([!#1])[!#1]	PADEL_KR840
PADEL_KR841	[!#1][NH]C(=O)[CH]([!#1])[CH]([CH3])[CH3]	PADEL_KR841
PADEL_KR842	[!#1][NH]C(=O)[CH]([!#1])[CH3]	PADEL_KR842
PADEL_KR843	[!#1][NH]C(=O)[CH]([!#1])C(=O)[NH][!#1]	PADEL_KR843
PADEL_KR844	[!#1][NH]C(=O)[CH]([!#1])C(=O)O[CH2][CH3]	PADEL_KR844
PADEL_KR845	[!#1][NH]C(=O)[CH]([CH](C(=O)[OH])C(=O)O[!#1])C(=O)O[!#1]	PADEL_KR845
PADEL_KR846	[!#1][NH]C(=O)[CH]([CH2][CH2][CH3])[CH2][CH2][CH3]	PADEL_KR846
PADEL_KR847	[!#1][NH]C(=O)[CH]([CH3])[CH2][SH](=O)=O	PADEL_KR847
PADEL_KR848	[!#1][NH]C(=O)[CH]([CH3])[NH]C(=O)[!#1]	PADEL_KR848
PADEL_KR849	[!#1][NH]C(=O)[CH]([CH3])Br	PADEL_KR849
PADEL_KR850	[!#1][NH]C(=O)[CH](C(=O)[!#1])S(=O)(=O)[!#1]	PADEL_KR850
PADEL_KR851	[!#1][NH]C(=O)[CH](OC(=O)[!#1])[CH](OC(=O)[!#1])C(=O)[OH]	PADEL_KR851
PADEL_KR852	[!#1][NH]C(=O)[CH]=[CH][!#1]	PADEL_KR852
PADEL_KR853	[!#1][NH]C(=O)[CH]=[CH][CH3]	PADEL_KR853
PADEL_KR854	[!#1][NH]C(=O)[CH]=[CH]C(=O)[OH]	PADEL_KR854
PADEL_KR855	[!#1][NH]C(=O)[CH]=[CH]C(=O)O[CH2]C(F)(F)[CH](F)F	PADEL_KR855
PADEL_KR856	[!#1][NH]C(=O)[CH]=[CH]c1[cH][cH][cH][cH][cH]1	PADEL_KR856
PADEL_KR857	[!#1][NH]C(=O)[CH]=[CH]c1[cH][cH][cH]c([cH]1)[N+](=O)[O-]	PADEL_KR857
PADEL_KR858	[!#1][NH]C(=O)[CH2][CH]([!#1])[NH]C(=O)C(F)(F)F	PADEL_KR858
PADEL_KR859	[!#1][NH]C(=O)[CH2][CH2][CH2][CH2][CH2][CH2]C(=O)[NH][!#1]	PADEL_KR859
PADEL_KR860	[!#1][NH]C(=O)[CH2][CH2][CH2][CH3]	PADEL_KR860
PADEL_KR861	[!#1][NH]C(=O)[CH2][CH2][CH2]C(=O)[NH][!#1]	PADEL_KR861
PADEL_KR862	[!#1][NH]C(=O)[CH2][CH2][CH2]C(=O)[OH]	PADEL_KR862
PADEL_KR863	[!#1][NH]C(=O)[CH2][CH2][CH2]C(=O)O[!#1]	PADEL_KR863
PADEL_KR864	[!#1][NH]C(=O)[CH2][CH2][CH2]C(=O)O[CH2]C#[CH]	PADEL_KR864
PADEL_KR865	[!#1][NH]C(=O)[CH2][CH2][CH2]O[!#1]	PADEL_KR865
PADEL_KR866	[!#1][NH]C(=O)[CH2][CH2][CH3]	PADEL_KR866
PADEL_KR867	[!#1][NH]C(=O)[CH2][CH2]C([CH3])([CH3])C(=O)[NH][!#1]	PADEL_KR867
PADEL_KR868	[!#1][NH]C(=O)[CH2][CH2]C(=O)[OH]	PADEL_KR868
PADEL_KR869	[!#1][NH]C(=O)[CH2][CH2]C(=O)O[!#1]	PADEL_KR869
PADEL_KR870	[!#1][NH]C(=O)[CH2][CH2]C(=O)O[CH2][CH]=[CH2]	PADEL_KR870
PADEL_KR871	[!#1][NH]C(=O)[CH2][CH2]C(=O)O[CH2]C(=C(Cl)Cl)Cl	PADEL_KR871
PADEL_KR872	[!#1][NH]C(=O)[CH2][CH2]C(=O)O[CH3]	PADEL_KR872
PADEL_KR873	[!#1][NH]C(=O)[CH2][CH2]Cl	PADEL_KR873
PADEL_KR874	[!#1][NH]C(=O)[CH2][CH3]	PADEL_KR874
PADEL_KR875	[!#1][NH]C(=O)[CH2][NH][CH]([CH3])[CH3]	PADEL_KR875
PADEL_KR876	[!#1][NH]C(=O)[CH2][NH]C([CH3])([CH3])[CH3]	PADEL_KR876
PADEL_KR877	[!#1][NH]C(=O)[CH2][SH]	PADEL_KR877
PADEL_KR878	[!#1][NH]C(=O)[CH2]C(=N[NH]C(=O)[!#1])[CH3]	PADEL_KR878
PADEL_KR879	[!#1][NH]C(=O)[CH2]C(=O)[!#1]	PADEL_KR879
PADEL_KR880	[!#1][NH]C(=O)[CH2]C(=O)[CH3]	PADEL_KR880
PADEL_KR881	[!#1][NH]C(=O)[CH2]C(=O)[NH][!#1]	PADEL_KR881
PADEL_KR882	[!#1][NH]C(=O)[CH2]Cl	PADEL_KR882
PADEL_KR883	[!#1][NH]C(=O)[CH2]N([CH2][CH2][CH2][CH3])[CH2][CH2][CH2][CH3]	PADEL_KR883
PADEL_KR884	[!#1][NH]C(=O)[CH2]N([CH2][CH3])[CH2][CH3]	PADEL_KR884
PADEL_KR885	[!#1][NH]C(=O)[CH2]N([CH3])[CH3]	PADEL_KR885
PADEL_KR886	[!#1][NH]C(=O)[CH2]O[!#1]	PADEL_KR886
PADEL_KR887	[!#1][NH]C(=O)[CH2]S[!#1]	PADEL_KR887
PADEL_KR888	[!#1][NH]C(=O)[CH2]S[CH2][CH2][NH2]	PADEL_KR888
PADEL_KR889	[!#1][NH]C(=O)[CH2]SC(=O)[!#1]	PADEL_KR889
PADEL_KR890	[!#1][NH]C(=O)[CH3]	PADEL_KR890
PADEL_KR891	[!#1][NH]C(=O)[NH][!#1]	PADEL_KR891
PADEL_KR892	[!#1][NH]C(=O)[NH][CH]([!#1])[CH3]	PADEL_KR892
PADEL_KR893	[!#1][NH]C(=O)[NH][CH]([CH2]C(=O)[!#1])C(Cl)(Cl)Cl	PADEL_KR893
PADEL_KR894	[!#1][NH]C(=O)[NH][CH2][CH2][CH2][OH]	PADEL_KR894
PADEL_KR895	[!#1][NH]C(=O)[NH][CH2][CH2][OH]	PADEL_KR895
PADEL_KR896	[!#1][NH]C(=O)[NH][CH3]	PADEL_KR896
PADEL_KR897	[!#1][NH]C(=O)[NH][NH]C(=O)[!#1]	PADEL_KR897
PADEL_KR898	[!#1][NH]C(=O)[NH][NH]C(=O)[CH2]O[!#1]	PADEL_KR898
PADEL_KR899	[!#1][NH]C(=O)[NH][NH]C(=O)O[CH3]	PADEL_KR899
PADEL_KR900	[!#1][NH]C(=O)[NH]C(=O)[!#1]	PADEL_KR900
PADEL_KR901	[!#1][NH]C(=O)[NH]C(=O)[CH2]O[!#1]	PADEL_KR901
PADEL_KR902	[!#1][NH]C(=O)[NH]C(=O)[NH2]	PADEL_KR902
PADEL_KR903	[!#1][NH]C(=O)[NH]C(=O)C(Cl)(Cl)Cl	PADEL_KR903
PADEL_KR904	[!#1][NH]C(=O)[NH]N=[CH][!#1]	PADEL_KR904
PADEL_KR905	[!#1][NH]C(=O)[NH]N=C([!#1])[CH3]	PADEL_KR905
PADEL_KR906	[!#1][NH]C(=O)[NH]S(=O)(=O)[!#1]	PADEL_KR906
PADEL_KR907	[!#1][NH]C(=O)[NH]S(=O)(=O)[NH][!#1]	PADEL_KR907
PADEL_KR908	[!#1][NH]C(=O)[NH2]	PADEL_KR908
PADEL_KR909	[!#1][NH]C(=O)C([!#1])([!#1])[NH][!#1]	PADEL_KR909
PADEL_KR910	[!#1][NH]C(=O)C([!#1])([!#1])[OH]	PADEL_KR910
PADEL_KR911	[!#1][NH]C(=O)C([!#1])(F)F	PADEL_KR911
PADEL_KR912	[!#1][NH]C(=O)C([CH3])([CH3])[CH3]	PADEL_KR912
PADEL_KR913	[!#1][NH]C(=O)C(=[CH][!#1])[NH]C(=O)[CH3]	PADEL_KR913
PADEL_KR914	[!#1][NH]C(=O)C(=[CH]c1[cH][cH][cH][cH][cH]1)[NH]C(=O)[CH3]	PADEL_KR914
PADEL_KR915	[!#1][NH]C(=O)C(=[CH2])[CH3]	PADEL_KR915
PADEL_KR916	[!#1][NH]C(=O)C(=O)[NH]N=C1C(=O)[NH]c2[cH][cH][cH][cH]c12	PADEL_KR916
PADEL_KR917	[!#1][NH]C(=O)C(Cl)(Cl)Cl	PADEL_KR917
PADEL_KR918	[!#1][NH]C(=O)C(F)(F)C(F)(F)F	PADEL_KR918
PADEL_KR919	[!#1][NH]C(=O)C(F)(F)F	PADEL_KR919
PADEL_KR920	[!#1][NH]C(=O)C(F)(F)OC(F)(F)C(F)(F)OC(F)(F)F	PADEL_KR920
PADEL_KR921	[!#1][NH]C(=O)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F	PADEL_KR921
PADEL_KR922	[!#1][NH]C(=O)N([!#1])[OH]	PADEL_KR922
PADEL_KR923	[!#1][NH]C(=O)N([CH]([CH3])[CH3])[CH]([CH3])[CH3]	PADEL_KR923
PADEL_KR924	[!#1][NH]C(=O)O[!#1]	PADEL_KR924
PADEL_KR925	[!#1][NH]C(=O)O[CH]([CH3])[CH3]	PADEL_KR925
PADEL_KR926	[!#1][NH]C(=O)O[CH2][CH2][CH2][NH]C(=O)[!#1]	PADEL_KR926
PADEL_KR927	[!#1][NH]C(=O)O[CH2][CH2][NH]C(=O)[!#1]	PADEL_KR927
PADEL_KR928	[!#1][NH]C(=O)O[CH2][CH2][NH]C(=O)O[CH3]	PADEL_KR928
PADEL_KR929	[!#1][NH]C(=O)O[CH2][CH2][NH]S(=O)(=O)[!#1]	PADEL_KR929
PADEL_KR930	[!#1][NH]C(=O)O[CH2][CH2]O[CH3]	PADEL_KR930
PADEL_KR931	[!#1][NH]C(=O)O[CH2][CH3]	PADEL_KR931
PADEL_KR932	[!#1][NH]C(=O)O[CH3]	PADEL_KR932
PADEL_KR933	[!#1][NH]C(=O)ON=[CH][!#1]	PADEL_KR933
PADEL_KR934	[!#1][NH]C(=O)ON=C([CH3])[CH3]	PADEL_KR934
PADEL_KR935	[!#1][NH]C(=O)S[CH2]C(=O)[!#1]	PADEL_KR935
PADEL_KR936	[!#1][NH]C(=S)[!#1]	PADEL_KR936
PADEL_KR937	[!#1][NH]C(=S)[NH][!#1]	PADEL_KR937
PADEL_KR938	[!#1][NH]C(=S)[NH][CH]([NH]C(=O)[!#1])C(Cl)(Cl)Cl	PADEL_KR938
PADEL_KR939	[!#1][NH]C(=S)[NH][CH]([NH]C(=O)[CH]([!#1])[!#1])C(Cl)(Cl)Cl	PADEL_KR939
PADEL_KR940	[!#1][NH]C(=S)[NH][CH]([NH]C(=O)[CH]([CH3])[CH3])C(Cl)(Cl)Cl	PADEL_KR940
PADEL_KR941	[!#1][NH]C(=S)[NH][CH]([NH]C(=O)[CH]=[CH][!#1])C(Cl)(Cl)Cl	PADEL_KR941
PADEL_KR942	[!#1][NH]C(=S)[NH][CH]([NH]C(=O)[CH]=[CH]c1[cH][cH][cH][cH][cH]1)C(Cl)(Cl)Cl	PADEL_KR942
PADEL_KR943	[!#1][NH]C(=S)[NH][CH]([NH]C(=O)[CH2][CH]([CH3])[CH3])C(Cl)(Cl)Cl	PADEL_KR943
PADEL_KR944	[!#1][NH]C(=S)[NH][CH]([NH]C(=O)[CH2][CH2][CH2][CH2][CH2][CH3])C(Cl)(Cl)Cl	PADEL_KR944
PADEL_KR945	[!#1][NH]C(=S)[NH][CH]([NH]C(=O)[CH2][CH2][CH2][CH2][CH3])C(Cl)(Cl)Cl	PADEL_KR945
PADEL_KR946	[!#1][NH]C(=S)[NH][CH]([NH]C(=O)[CH2][CH2][CH3])C(Cl)(Cl)Cl	PADEL_KR946
PADEL_KR947	[!#1][NH]C(=S)[NH][CH]([NH]C(=O)[CH2][CH3])C(Cl)(Cl)Cl	PADEL_KR947
PADEL_KR948	[!#1][NH]C(=S)[NH][CH]([NH]C(=O)[CH2]F)C(Cl)(Cl)Cl	PADEL_KR948
PADEL_KR949	[!#1][NH]C(=S)[NH][CH]([NH]C(=O)[CH3])C(Cl)(Cl)Cl	PADEL_KR949
PADEL_KR950	[!#1][NH]C(=S)[NH][CH]([NH]C(=O)C([CH3])([CH3])[CH3])C(Cl)(Cl)Cl	PADEL_KR950
PADEL_KR951	[!#1][NH]C(=S)[NH][CH](N=C([!#1])O[CH3])C(Cl)(Cl)Cl	PADEL_KR951
PADEL_KR952	[!#1][NH]C(=S)[NH]C(=C(C(F)(F)F)C(F)(F)F)C(F)(F)C(F)(F)F	PADEL_KR952
PADEL_KR953	[!#1][NH]C(=S)[NH]C(=N[CH2]S(=O)(=O)[!#1])[!#1]	PADEL_KR953
PADEL_KR954	[!#1][NH]C(=S)[NH]C(=O)[!#1]	PADEL_KR954
PADEL_KR955	[!#1][NH]C(=S)[NH]C(=O)[CH]=[CH][!#1]	PADEL_KR955
PADEL_KR956	[!#1][NH]C(=S)[NH]C(=O)[CH]=[CH]c1[cH][cH][cH][cH][cH]1	PADEL_KR956
PADEL_KR957	[!#1][NH]C(=S)[NH]C(=O)[CH]=[CH]c1[cH][cH][cH]o1	PADEL_KR957
PADEL_KR958	[!#1][NH]C(=S)[NH]C(=O)[CH]=[CH]c1[cH][cH]c(F)[cH][cH]1	PADEL_KR958
PADEL_KR959	[!#1][NH]C(=S)[NH]C(=O)[CH]=[CH]c1[cH][cH]c(O[CH3])c(O[CH3])[cH]1	PADEL_KR959
PADEL_KR960	[!#1][NH]C(=S)[NH]c1[cH][cH]c([cH][cH]1)S(=O)(=O)[!#1]	PADEL_KR960
PADEL_KR961	[!#1][NH]C(=S)[NH]N=[CH][!#1]	PADEL_KR961
PADEL_KR962	[!#1][NH]C(=S)[NH]N=C([!#1])[CH3]	PADEL_KR962
PADEL_KR963	[!#1][NH]C(=S)[NH2]	PADEL_KR963
PADEL_KR964	[!#1][NH]C(=S)O[CH2][CH2][CH3]	PADEL_KR964
PADEL_KR965	[!#1][NH]C(=S)SC([!#1])([!#1])C(=O)[!#1]	PADEL_KR965
PADEL_KR966	[!#1][NH]C1([CH2][CH]2[CH2][CH]3[CH2][CH]([CH2]2)[CH2]1)[CH2]3	PADEL_KR966
PADEL_KR967	[!#1][NH]C1([CH2][CH2][CH2][CH2][CH2]1)C(=O)[!#1]	PADEL_KR967
PADEL_KR968	[!#1][NH]C1([CH2][CH2][CH2][CH2][CH2]1)c2nnnn2[!#1]	PADEL_KR968
PADEL_KR969	[!#1][NH]C1([CH2][CH2][CH2][CH2]1)C(=O)[!#1]	PADEL_KR969
PADEL_KR970	[!#1][NH]C1([CH3])C(=O)c2[cH][cH][cH][cH]c2C1=O	PADEL_KR970
PADEL_KR971	[!#1][NH]C1(C(=O)c2[cH][cH][cH][cH]c2C1=O)c3[cH][cH][cH][cH][cH]3	PADEL_KR971
PADEL_KR972	[!#1][NH]c1[cH][cH][cH][cH][cH]1	PADEL_KR972
PADEL_KR973	[!#1][NH]c1[cH][cH][cH][cH]c1[!#1]	PADEL_KR973
PADEL_KR974	[!#1][NH]c1[cH][cH][cH][cH]c1[CH2][CH3]	PADEL_KR974
PADEL_KR975	[!#1][NH]c1[cH][cH][cH][cH]c1[CH3]	PADEL_KR975
PADEL_KR976	[!#1][NH]c1[cH][cH][cH][cH]c1[N+](=O)[O-]	PADEL_KR976
PADEL_KR977	[!#1][NH]c1[cH][cH][cH][cH]c1[NH][!#1]	PADEL_KR977
PADEL_KR978	[!#1][NH]c1[cH][cH][cH][cH]c1[OH]	PADEL_KR978
PADEL_KR979	[!#1][NH]c1[cH][cH][cH][cH]c1Br	PADEL_KR979
PADEL_KR980	[!#1][NH]c1[cH][cH][cH][cH]c1C([!#1])([!#1])C(=O)[!#1]	PADEL_KR980
PADEL_KR981	[!#1][NH]c1[cH][cH][cH][cH]c1C([OH])([CH2]C(=N[NH]C(=O)[CH2]O[!#1])[CH3])C(=O)[!#1]	PADEL_KR981
PADEL_KR982	[!#1][NH]c1[cH][cH][cH][cH]c1C(=N[!#1])C(=O)[!#1]	PADEL_KR982
PADEL_KR983	[!#1][NH]c1[cH][cH][cH][cH]c1C(=O)[!#1]	PADEL_KR983
PADEL_KR984	[!#1][NH]c1[cH][cH][cH][cH]c1C(=O)[OH]	PADEL_KR984
PADEL_KR985	[!#1][NH]c1[cH][cH][cH][cH]c1C(F)(F)F	PADEL_KR985
PADEL_KR986	[!#1][NH]c1[cH][cH][cH][cH]c1Cl	PADEL_KR986
PADEL_KR987	[!#1][NH]c1[cH][cH][cH][cH]c1F	PADEL_KR987
PADEL_KR988	[!#1][NH]c1[cH][cH][cH][cH]c1I	PADEL_KR988
PADEL_KR989	[!#1][NH]c1[cH][cH][cH][cH]c1O[!#1]	PADEL_KR989
PADEL_KR990	[!#1][NH]c1[cH][cH][cH][cH]c1S[CH]([CH2]C(=O)[!#1])C(=O)[!#1]	PADEL_KR990
PADEL_KR991	[!#1][NH]c1[cH][cH][cH][cH]n1	PADEL_KR991
PADEL_KR992	[!#1][NH]c1[cH][cH][cH]c([!#1])[cH]1	PADEL_KR992
PADEL_KR993	[!#1][NH]c1[cH][cH][cH]c([cH]1)[CH]([!#1])[!#1]	PADEL_KR993
PADEL_KR994	[!#1][NH]c1[cH][cH][cH]c([cH]1)[N+](=O)[O-]	PADEL_KR994
PADEL_KR995	[!#1][NH]c1[cH][cH][cH]c([cH]1)C(=O)[!#1]	PADEL_KR995
PADEL_KR996	[!#1][NH]c1[cH][cH][cH]c([cH]1)C(=O)[CH3]	PADEL_KR996
PADEL_KR997	[!#1][NH]c1[cH][cH][cH]c([cH]1)C(=O)[OH]	PADEL_KR997
PADEL_KR998	[!#1][NH]c1[cH][cH][cH]c([cH]1)C(F)(F)F	PADEL_KR998
PADEL_KR999	[!#1][NH]c1[cH][cH][cH]c([CH3])[cH]1	PADEL_KR999
PADEL_KR1000	[!#1][NH]c1[cH][cH][cH]c([CH3])c1[CH3]	PADEL_KR1000
PADEL_KR1001	[!#1][NH]c1[cH][cH][cH]c([NH][!#1])[cH]1	PADEL_KR1001
PADEL_KR1002	[!#1][NH]c1[cH][cH][cH]c([OH])[cH]1	PADEL_KR1002
PADEL_KR1003	[!#1][NH]c1[cH][cH][cH]c(Br)[cH]1	PADEL_KR1003
PADEL_KR1004	[!#1][NH]c1[cH][cH][cH]c(Cl)[cH]1	PADEL_KR1004
PADEL_KR1005	[!#1][NH]c1[cH][cH][cH]c(Cl)c1[CH3]	PADEL_KR1005
PADEL_KR1006	[!#1][NH]c1[cH][cH][cH]c(Cl)c1Cl	PADEL_KR1006
PADEL_KR1007	[!#1][NH]c1[cH][cH][cH]c(F)[cH]1	PADEL_KR1007
PADEL_KR1008	[!#1][NH]c1[cH][cH][cH]c(O[!#1])[cH]1	PADEL_KR1008
PADEL_KR1009	[!#1][NH]c1[cH][cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR1009
PADEL_KR1010	[!#1][NH]c1[cH][cH][cH]c2[cH][cH][cH]nc12	PADEL_KR1010
PADEL_KR1011	[!#1][NH]c1[cH][cH][cH]c2c([NH][!#1])[cH][cH][cH]c12	PADEL_KR1011
PADEL_KR1012	[!#1][NH]c1[cH][cH][cH]c2C(=O)c3[cH][cH][cH][cH]c3C(=O)c12	PADEL_KR1012
PADEL_KR1013	[!#1][NH]c1[cH][cH]c([!#1])[cH][cH]1	PADEL_KR1013
PADEL_KR1014	[!#1][NH]c1[cH][cH]c([!#1])[cH]c1[CH3]	PADEL_KR1014
PADEL_KR1015	[!#1][NH]c1[cH][cH]c([!#1])[cH]c1[N+](=O)[O-]	PADEL_KR1015
PADEL_KR1016	[!#1][NH]c1[cH][cH]c([!#1])c([cH]1)S(=O)(=O)c2[cH]c([NH][!#1])[cH][cH]c2[!#1]	PADEL_KR1016
PADEL_KR1017	[!#1][NH]c1[cH][cH]c([CH]([!#1])[!#1])c([cH]1)S(=O)(=O)[OH]	PADEL_KR1017
PADEL_KR1018	[!#1][NH]c1[cH][cH]c([cH][cH]1)[CH]([!#1])[!#1]	PADEL_KR1018
PADEL_KR1019	[!#1][NH]c1[cH][cH]c([cH][cH]1)[CH]([CH3])[CH3]	PADEL_KR1019
PADEL_KR1020	[!#1][NH]c1[cH][cH]c([cH][cH]1)[N+](=O)[O-]	PADEL_KR1020
PADEL_KR1021	[!#1][NH]c1[cH][cH]c([cH][cH]1)C(=O)[!#1]	PADEL_KR1021
PADEL_KR1022	[!#1][NH]c1[cH][cH]c([cH][cH]1)C(=O)[CH3]	PADEL_KR1022
PADEL_KR1023	[!#1][NH]c1[cH][cH]c([cH][cH]1)C(=O)[OH]	PADEL_KR1023
PADEL_KR1024	[!#1][NH]c1[cH][cH]c([cH][cH]1)S(=O)(=O)[!#1]	PADEL_KR1024
PADEL_KR1025	[!#1][NH]c1[cH][cH]c([cH]c1[N+](=O)[O-])[N+](=O)[O-]	PADEL_KR1025
PADEL_KR1026	[!#1][NH]c1[cH][cH]c([cH]c1[N+](=O)[O-])C(=O)[OH]	PADEL_KR1026
PADEL_KR1027	[!#1][NH]c1[cH][cH]c([cH]c1C(=N[NH]C(=O)[CH2]O[!#1])C(=O)[!#1])[N+](=O)[O-]	PADEL_KR1027
PADEL_KR1028	[!#1][NH]c1[cH][cH]c([CH2][CH2]c2[cH][cH][cH][cH]c2[!#1])c([NH][!#1])[cH]1	PADEL_KR1028
PADEL_KR1029	[!#1][NH]c1[cH][cH]c([CH2]c2[cH][cH]c([NH][!#1])[cH][cH]2)[cH][cH]1	PADEL_KR1029
PADEL_KR1030	[!#1][NH]c1[cH][cH]c([CH3])[cH][cH]1	PADEL_KR1030
PADEL_KR1031	[!#1][NH]c1[cH][cH]c([CH3])[cH]c1[CH3]	PADEL_KR1031
PADEL_KR1032	[!#1][NH]c1[cH][cH]c([CH3])[cH]c1[N+](=O)[O-]	PADEL_KR1032
PADEL_KR1033	[!#1][NH]c1[cH][cH]c([CH3])c([cH]1)[N+](=O)[O-]	PADEL_KR1033
PADEL_KR1034	[!#1][NH]c1[cH][cH]c([CH3])c([CH3])[cH]1	PADEL_KR1034
PADEL_KR1035	[!#1][NH]c1[cH][cH]c([CH3])c([NH][!#1])[cH]1	PADEL_KR1035
PADEL_KR1036	[!#1][NH]c1[cH][cH]c([N+](=O)[O-])c2nonc12	PADEL_KR1036
PADEL_KR1037	[!#1][NH]c1[cH][cH]c([NH][!#1])[cH][cH]1	PADEL_KR1037
PADEL_KR1038	[!#1][NH]c1[cH][cH]c([OH])[cH][cH]1	PADEL_KR1038
PADEL_KR1039	[!#1][NH]c1[cH][cH]c(Br)[cH][cH]1	PADEL_KR1039
PADEL_KR1040	[!#1][NH]c1[cH][cH]c(Br)[cH]c1C(=O)[!#1]	PADEL_KR1040
PADEL_KR1041	[!#1][NH]c1[cH][cH]c(Br)[cH]n1	PADEL_KR1041
PADEL_KR1042	[!#1][NH]c1[cH][cH]c(Cl)[cH][cH]1	PADEL_KR1042
PADEL_KR1043	[!#1][NH]c1[cH][cH]c(Cl)[cH]c1[N+](=O)[O-]	PADEL_KR1043
PADEL_KR1044	[!#1][NH]c1[cH][cH]c(Cl)[cH]c1C(=O)[!#1]	PADEL_KR1044
PADEL_KR1045	[!#1][NH]c1[cH][cH]c(Cl)[cH]c1Cl	PADEL_KR1045
PADEL_KR1046	[!#1][NH]c1[cH][cH]c(Cl)[cH]n1	PADEL_KR1046
PADEL_KR1047	[!#1][NH]c1[cH][cH]c(Cl)c([cH]1)[N+](=O)[O-]	PADEL_KR1047
PADEL_KR1048	[!#1][NH]c1[cH][cH]c(Cl)c(Cl)[cH]1	PADEL_KR1048
PADEL_KR1049	[!#1][NH]c1[cH][cH]c(F)[cH][cH]1	PADEL_KR1049
PADEL_KR1050	[!#1][NH]c1[cH][cH]c(F)c(Cl)[cH]1	PADEL_KR1050
PADEL_KR1051	[!#1][NH]c1[cH][cH]c(I)[cH][cH]1	PADEL_KR1051
PADEL_KR1052	[!#1][NH]c1[cH][cH]c(N([!#1])[CH2][CH3])c2c([cH][cH][cH]c12)C(=O)[!#1]	PADEL_KR1052
PADEL_KR1053	[!#1][NH]c1[cH][cH]c(N=Nc2[cH][cH][cH][cH][cH]2)[cH][cH]1	PADEL_KR1053
PADEL_KR1054	[!#1][NH]c1[cH][cH]c(N=Nc2[cH][cH][cH][cH]c2[CH3])[cH]c1[CH3]	PADEL_KR1054
PADEL_KR1055	[!#1][NH]c1[cH][cH]c(O[!#1])[cH][cH]1	PADEL_KR1055
PADEL_KR1056	[!#1][NH]c1[cH][cH]c(O[!#1])[cH]c1[N+](=O)[O-]	PADEL_KR1056
PADEL_KR1057	[!#1][NH]c1[cH][cH]c(O[CH3])nn1	PADEL_KR1057
PADEL_KR1058	[!#1][NH]c1[cH][cH]c2[cH][cH][cH][cH]c2[cH]1	PADEL_KR1058
PADEL_KR1059	[!#1][NH]c1[cH][cH]c2[cH][cH][cH]c([OH])c2n1	PADEL_KR1059
PADEL_KR1060	[!#1][NH]c1[cH][cH]c2[CH2][CH2]c3[cH][cH][cH][cH]c3N([!#1])c2[cH]1	PADEL_KR1060
PADEL_KR1061	[!#1][NH]c1[cH][cH]c2c([cH]1)oc3[cH][cH][cH][cH]c32	PADEL_KR1061
PADEL_KR1062	[!#1][NH]c1[cH][cH]c2nc([!#1])[nH]c2[cH]1	PADEL_KR1062
PADEL_KR1063	[!#1][NH]c1[cH][cH]c2nonc2c1[N+](=O)[O-]	PADEL_KR1063
PADEL_KR1064	[!#1][NH]c1[cH][cH]c2O[CH2]Oc2[cH]1	PADEL_KR1064
PADEL_KR1065	[!#1][NH]c1[cH][cH]c2oc([!#1])nc2[cH]1	PADEL_KR1065
PADEL_KR1066	[!#1][NH]c1[cH][cH]n[cH][cH]1	PADEL_KR1066
PADEL_KR1067	[!#1][NH]c1[cH][cH]nc2[cH]c3[cH][cH][cH][cH]c3[cH]c12	PADEL_KR1067
PADEL_KR1068	[!#1][NH]c1[cH]c([!#1])nc2[cH][cH][cH][cH]c12	PADEL_KR1068
PADEL_KR1069	[!#1][NH]c1[cH]c([cH][cH]c1[CH3])[N+](=O)[O-]	PADEL_KR1069
PADEL_KR1070	[!#1][NH]c1[cH]c([cH][cH]c1C(=O)[OH])[N+](=O)[O-]	PADEL_KR1070
PADEL_KR1071	[!#1][NH]c1[cH]c([cH][cH]c1Cl)C(F)(F)F	PADEL_KR1071
PADEL_KR1072	[!#1][NH]c1[cH]c([cH]c([cH]1)[N+](=O)[O-])C(=O)[OH]	PADEL_KR1072
PADEL_KR1073	[!#1][NH]c1[cH]c([cH]c([cH]1)C(=O)[OH])C(=O)[OH]	PADEL_KR1073
PADEL_KR1074	[!#1][NH]c1[cH]c([CH3])[cH][cH]c1[CH3]	PADEL_KR1074
PADEL_KR1075	[!#1][NH]c1[cH]c([CH3])[cH][cH]n1	PADEL_KR1075
PADEL_KR1076	[!#1][NH]c1[cH]c([CH3])[cH]c([CH3])[cH]1	PADEL_KR1076
PADEL_KR1077	[!#1][NH]c1[cH]c([CH3])nc2[cH][cH][cH][cH]c12	PADEL_KR1077
PADEL_KR1078	[!#1][NH]c1[cH]c(Cl)[cH][cH]c1Cl	PADEL_KR1078
PADEL_KR1079	[!#1][NH]c1[cH]c(Cl)[cH][cH]c1O[!#1]	PADEL_KR1079
PADEL_KR1080	[!#1][NH]c1[cH]c(O[!#1])c(O[!#1])[cH]c1C(=O)[!#1]	PADEL_KR1080
PADEL_KR1081	[!#1][NH]c1[cH]c(O[CH3])nc(O[CH3])n1	PADEL_KR1081
PADEL_KR1082	[!#1][NH]c1[cH]nc2[cH][cH][cH][cH]c2[cH]1	PADEL_KR1082
PADEL_KR1083	[!#1][NH]c1[nH]nc([CH3])c1[N+](=O)[O-]	PADEL_KR1083
PADEL_KR1084	[!#1][NH]C1=[CH]C(=O)c2[cH][cH][cH][cH]c2C1=O	PADEL_KR1084
PADEL_KR1085	[!#1][NH]c1c([cH][cH]c2nonc12)[N+](=O)[O-]	PADEL_KR1085
PADEL_KR1086	[!#1][NH]c1c([cH]c([cH]c1[N+](=O)[O-])[N+](=O)[O-])C(=O)[OH]	PADEL_KR1086
PADEL_KR1087	[!#1][NH]c1c([cH]c([cH]c1[N+](=O)[O-])C(=O)[OH])[N+](=O)[O-]	PADEL_KR1087
PADEL_KR1088	[!#1][NH]c1c([cH]c([N+](=O)[O-])c2[cH][cH][cH][cH]c12)[N+](=O)[O-]	PADEL_KR1088
PADEL_KR1089	[!#1][NH]c1c([CH3])[cH][cH][cH]c1[CH3]	PADEL_KR1089
PADEL_KR1090	[!#1][NH]c1c([CH3])[cH]c([CH3])[cH]c1[CH3]	PADEL_KR1090
PADEL_KR1091	[!#1][NH]c1c([CH3])c([CH2][CH3])nc2[cH][cH][cH][cH]c12	PADEL_KR1091
PADEL_KR1092	[!#1][NH]c1c([CH3])n([!#1])n([!#1])c1=O	PADEL_KR1092
PADEL_KR1093	[!#1][NH]c1c([N+](=O)[O-])c(=O)oc2[cH][cH][cH][cH]c12	PADEL_KR1093
PADEL_KR1094	[!#1][NH]c1c2[cH][cH][cH][cH]c2nc3[cH][cH][cH][cH]c13	PADEL_KR1094
PADEL_KR1095	[!#1][NH]c1c2[CH2][CH2][CH2]c2nc3[cH][cH][cH][cH]c13	PADEL_KR1095
PADEL_KR1096	[!#1][NH]c1c2[CH2][CH2][CH2]c2nc3[CH2][CH2][CH2][CH2]c13	PADEL_KR1096
PADEL_KR1097	[!#1][NH]c1n[cH][cH][cH]n1	PADEL_KR1097
PADEL_KR1098	[!#1][NH]c1n[cH][cH]nc1O[CH3]	PADEL_KR1098
PADEL_KR1099	[!#1][NH]c1n[cH][cH]s1	PADEL_KR1099
PADEL_KR1100	[!#1][NH]c1n[cH][nH]n1	PADEL_KR1100
PADEL_KR1101	[!#1][NH]c1n[cH]nc2n([!#1])[cH]nc12	PADEL_KR1101
PADEL_KR1102	[!#1][NH]c1n[cH]nc2sc3[CH2][CH2][CH2][CH2]c3c12	PADEL_KR1102
PADEL_KR1103	[!#1][NH]c1n[nH]c(=O)[nH]c1=O	PADEL_KR1103
PADEL_KR1104	[!#1][NH]c1nc([!#1])[cH]s1	PADEL_KR1104
PADEL_KR1105	[!#1][NH]c1nc([!#1])nc([!#1])n1	PADEL_KR1105
PADEL_KR1106	[!#1][NH]c1nc([!#1])nc(Cl)n1	PADEL_KR1106
PADEL_KR1107	[!#1][NH]c1nc([!#1])nc(n1)N2[CH2][CH2]O[CH2][CH2]2	PADEL_KR1107
PADEL_KR1108	[!#1][NH]c1nc([!#1])nc(O[CH](C(F)(F)F)C(F)(F)F)n1	PADEL_KR1108
PADEL_KR1109	[!#1][NH]c1nc([cH]s1)c2[cH][cH][cH][cH][cH]2	PADEL_KR1109
PADEL_KR1110	[!#1][NH]c1nc([cH]s1)c2[cH][cH]c([!#1])[cH][cH]2	PADEL_KR1110
PADEL_KR1111	[!#1][NH]c1nc([CH3])[cH]c([CH3])n1	PADEL_KR1111
PADEL_KR1112	[!#1][NH]c1nc(Cl)nc(Cl)n1	PADEL_KR1112
PADEL_KR1113	[!#1][NH]c1nc(O[CH](C(F)(F)F)C(F)(F)F)nc(O[CH](C(F)(F)F)C(F)(F)F)n1	PADEL_KR1113
PADEL_KR1114	[!#1][NH]c1nc2[cH][cH][cH][cH]c2n1[!#1]	PADEL_KR1114
PADEL_KR1115	[!#1][NH]c1nc2[cH][cH][cH][cH]c2nc1[!#1]	PADEL_KR1115
PADEL_KR1116	[!#1][NH]c1nc2[cH][cH][cH][cH]c2nc1[NH][!#1]	PADEL_KR1116
PADEL_KR1117	[!#1][NH]c1nc2[cH][cH][cH][cH]c2s1	PADEL_KR1117
PADEL_KR1118	[!#1][NH]c1nc2[CH2][CH2][CH2][CH2]c2s1	PADEL_KR1118
PADEL_KR1119	[!#1][NH]c1nc2nonc2nc1[!#1]	PADEL_KR1119
PADEL_KR1120	[!#1][NH]c1nnc([CH2][CH3])s1	PADEL_KR1120
PADEL_KR1121	[!#1][NH]c1nnc([CH3])s1	PADEL_KR1121
PADEL_KR1122	[!#1][NH]c1sc([CH3])c([CH3])c1C(=O)[!#1]	PADEL_KR1122
PADEL_KR1123	[!#1][NH]c1sc2[CH2][CH2][CH2][CH2]c2c1C(=O)[!#1]	PADEL_KR1123
PADEL_KR1124	[!#1][NH]N([!#1])[!#1]	PADEL_KR1124
PADEL_KR1125	[!#1][NH]N=[CH][!#1]	PADEL_KR1125
PADEL_KR1126	[!#1][NH]N=C([!#1])[!#1]	PADEL_KR1126
PADEL_KR1127	[!#1][NH]N=C([!#1])[CH3]	PADEL_KR1127
PADEL_KR1128	[!#1][NH]N=C([!#1])N=N[!#1]	PADEL_KR1128
PADEL_KR1129	[!#1][NH]N=C1C(=N[NH]C1=O)[!#1]	PADEL_KR1129
PADEL_KR1130	[!#1][NH]N=C1C(=NN(C1=O)c2[cH][cH][cH][cH][cH]2)[!#1]	PADEL_KR1130
PADEL_KR1131	[!#1][NH]N=C1C(=NN(C1=O)c2nc([cH]s2)c3[cH][cH][cH][cH][cH]3)[!#1]	PADEL_KR1131
PADEL_KR1132	[!#1][NH]N=C1C(=O)[NH]C(=O)[NH]C1=O	PADEL_KR1132
PADEL_KR1133	[!#1][NH]N=C1C(=O)[NH]C(=S)[NH]C1=O	PADEL_KR1133
PADEL_KR1134	[!#1][NH]N=N[!#1]	PADEL_KR1134
PADEL_KR1135	[!#1][NH]n1[cH]nn[cH]1	PADEL_KR1135
PADEL_KR1136	[!#1][NH]P(=O)(O[CH]([CH3])[CH3])O[CH]([CH3])[CH3]	PADEL_KR1136
PADEL_KR1137	[!#1][NH]P(=O)(O[CH2][CH]([CH3])[CH3])O[CH2][CH]([CH3])[CH3]	PADEL_KR1137
PADEL_KR1138	[!#1][NH]P(=O)(O[CH2][CH3])O[CH2][CH3]	PADEL_KR1138
PADEL_KR1139	[!#1][NH]S(=O)(=O)[!#1]	PADEL_KR1139
PADEL_KR1140	[!#1][NH]S(=O)(=O)[CH2][CH]=[CH2]	PADEL_KR1140
PADEL_KR1141	[!#1][NH]S(=O)(=O)[CH3]	PADEL_KR1141
PADEL_KR1142	[!#1][NH]S(=O)(=O)[NH]C([CH3])([CH3])[CH3]	PADEL_KR1142
PADEL_KR1143	[!#1][NH]S(=O)(=O)[NH]C(=O)N([!#1])[CH3]	PADEL_KR1143
PADEL_KR1144	[!#1][NH]S(=O)[!#1]	PADEL_KR1144
PADEL_KR1145	[!#1][NH]S[!#1]	PADEL_KR1145
PADEL_KR1146	[!#1][NH2]	PADEL_KR1146
PADEL_KR1147	[!#1][O-]	PADEL_KR1147
PADEL_KR1148	[!#1][OH]	PADEL_KR1148
PADEL_KR1149	[!#1][SH]	PADEL_KR1149
PADEL_KR1150	[!#1]Br	PADEL_KR1150
PADEL_KR1151	[!#1]C#C[!#1]	PADEL_KR1151
PADEL_KR1152	[!#1]C#CC([CH3])([CH3])[OH]	PADEL_KR1152
PADEL_KR1153	[!#1]C#N	PADEL_KR1153
PADEL_KR1154	[!#1]C([!#1])([!#1])[!#1]	PADEL_KR1154
PADEL_KR1155	[!#1]C([!#1])([!#1])[CH2][CH3]	PADEL_KR1155
PADEL_KR1156	[!#1]C([!#1])([!#1])[CH3]	PADEL_KR1156
PADEL_KR1157	[!#1]C([!#1])([!#1])[OH]	PADEL_KR1157
PADEL_KR1158	[!#1]C([!#1])([!#1])c1[cH][cH][cH][cH][cH]1	PADEL_KR1158
PADEL_KR1159	[!#1]C([!#1])([CH3])[CH2][CH3]	PADEL_KR1159
PADEL_KR1160	[!#1]C([!#1])([CH3])[CH3]	PADEL_KR1160
PADEL_KR1161	[!#1]C([!#1])([CH3])[OH]	PADEL_KR1161
PADEL_KR1162	[!#1]C([!#1])([OH])c1[cH][cH][cH][cH][cH]1	PADEL_KR1162
PADEL_KR1163	[!#1]C([!#1])(C#N)C#N	PADEL_KR1163
PADEL_KR1164	[!#1]C([!#1])(Cl)C([!#1])([!#1])[N+](=O)[O-]	PADEL_KR1164
PADEL_KR1165	[!#1]C([!#1])(Cl)Cl	PADEL_KR1165
PADEL_KR1166	[!#1]C([CH3])([CH3])[CH2][CH]([CH3])[OH]	PADEL_KR1166
PADEL_KR1167	[!#1]C([CH3])([CH3])[CH2][CH]([CH3])OC(=O)C([CH3])([CH3])[CH3]	PADEL_KR1167
PADEL_KR1168	[!#1]C([CH3])([CH3])[CH2][CH]=C([CH3])[CH2][CH2][CH]=C([CH3])[CH3]	PADEL_KR1168
PADEL_KR1169	[!#1]C([CH3])([CH3])[CH2][CH3]	PADEL_KR1169
PADEL_KR1170	[!#1]C([CH3])([CH3])[CH2][OH]	PADEL_KR1170
PADEL_KR1171	[!#1]C([CH3])([CH3])[CH2]C([CH3])([CH3])[CH3]	PADEL_KR1171
PADEL_KR1172	[!#1]C([CH3])([CH3])[CH2]N([CH3])[CH3]	PADEL_KR1172
PADEL_KR1173	[!#1]C([CH3])([CH3])[CH3]	PADEL_KR1173
PADEL_KR1174	[!#1]C([OH])([CH2][CH]=[CH2])[CH2][CH]=[CH2]	PADEL_KR1174
PADEL_KR1175	[!#1]C([OH])(C(=O)O[CH2][CH3])C(F)(F)F	PADEL_KR1175
PADEL_KR1176	[!#1]C([OH])(C(=O)O[CH3])C(F)(F)F	PADEL_KR1176
PADEL_KR1177	[!#1]C([OH])(C(F)(F)F)C(F)(F)F	PADEL_KR1177
PADEL_KR1178	[!#1]C(=[CH]C(=O)[CH3])[CH3]	PADEL_KR1178
PADEL_KR1179	[!#1]C(=[CH]C(=O)O[CH2][CH3])[CH3]	PADEL_KR1179
PADEL_KR1180	[!#1]C(=N[NH]C(=O)[!#1])[!#1]	PADEL_KR1180
PADEL_KR1181	[!#1]C(=N[NH]C(=O)[!#1])[CH3]	PADEL_KR1181
PADEL_KR1182	[!#1]C(=N[NH]C(=O)[NH2])[CH3]	PADEL_KR1182
PADEL_KR1183	[!#1]C(=N[NH]S(=O)(=O)[!#1])[CH3]	PADEL_KR1183
PADEL_KR1184	[!#1]C(=N[OH])[!#1]	PADEL_KR1184
PADEL_KR1185	[!#1]C(=N[OH])[CH2][CH]([CH3])[CH3]	PADEL_KR1185
PADEL_KR1186	[!#1]C(=N[OH])[CH2][CH3]	PADEL_KR1186
PADEL_KR1187	[!#1]C(=N[OH])[CH3]	PADEL_KR1187
PADEL_KR1188	[!#1]C(=N[OH])N([CH2][CH3])[CH2][CH3]	PADEL_KR1188
PADEL_KR1189	[!#1]C(=NN=C([!#1])[CH3])[CH3]	PADEL_KR1189
PADEL_KR1190	[!#1]C(=NO[CH2][CH3])[CH2][CH2][CH3]	PADEL_KR1190
PADEL_KR1191	[!#1]C(=NO[CH2]ON=C([!#1])[CH3])[CH3]	PADEL_KR1191
PADEL_KR1192	[!#1]C(=NOC(=O)[!#1])[CH3]	PADEL_KR1192
PADEL_KR1193	[!#1]C(=O)[!#1]	PADEL_KR1193
PADEL_KR1194	[!#1]C(=O)[CH]([CH]1[CH2][CH2][CH2][CH2][CH2]1)C(=O)[!#1]	PADEL_KR1194
PADEL_KR1195	[!#1]C(=O)[CH]([CH3])[CH3]	PADEL_KR1195
PADEL_KR1196	[!#1]C(=O)[CH]([CH3])c1[cH][cH]c([CH2][CH]([CH3])[CH3])[cH][cH]1	PADEL_KR1196
PADEL_KR1197	[!#1]C(=O)[CH]([CH3])N([CH3])[CH3]	PADEL_KR1197
PADEL_KR1198	[!#1]C(=O)[CH](c1[cH][cH][cH][cH][cH]1)c2[cH][cH][cH][cH][cH]2	PADEL_KR1198
PADEL_KR1199	[!#1]C(=O)[CH](F)F	PADEL_KR1199
PADEL_KR1200	[!#1]C(=O)[CH]1[CH]([CH]2c3[cH][cH][cH][cH]c3[CH]1c4[cH][cH][cH][cH]c24)C(=O)[OH]	PADEL_KR1200
PADEL_KR1201	[!#1]C(=O)[CH]1[CH]2[CH2][CH2][CH2][CH2][CH]12	PADEL_KR1201
PADEL_KR1202	[!#1]C(=O)[CH]1[CH2][CH]1c2[cH][cH][cH][cH][cH]2	PADEL_KR1202
PADEL_KR1203	[!#1]C(=O)[CH]1[CH2][CH2][CH2][CH2][CH2]1	PADEL_KR1203
PADEL_KR1204	[!#1]C(=O)[CH]1[CH2][CH2]1	PADEL_KR1204
PADEL_KR1205	[!#1]C(=O)[CH]1[CH2][CH2]C([CH3])(C(=O)[OH])C1([CH3])[CH3]	PADEL_KR1205
PADEL_KR1206	[!#1]C(=O)[CH]1[CH2]C1([CH3])[CH3]	PADEL_KR1206
PADEL_KR1207	[!#1]C(=O)[CH]1[CH2]C1(c2[cH][cH][cH][cH][cH]2)c3[cH][cH][cH][cH][cH]3	PADEL_KR1207
PADEL_KR1208	[!#1]C(=O)[CH]1[CH2]C1(c2[cH][cH]c([CH3])[cH][cH]2)c3[cH][cH]c([CH3])[cH][cH]3	PADEL_KR1208
PADEL_KR1209	[!#1]C(=O)[CH]1[CH2]C21[CH2][CH2][CH2]2	PADEL_KR1209
PADEL_KR1210	[!#1]C(=O)[CH]1C(=O)C([!#1])([!#1])C(=O)[CH2]C1([CH3])[CH3]	PADEL_KR1210
PADEL_KR1211	[!#1]C(=O)[CH2][CH]([CH3])[CH2]C(=O)[!#1]	PADEL_KR1211
PADEL_KR1212	[!#1]C(=O)[CH2][CH]([CH3])[CH3]	PADEL_KR1212
PADEL_KR1213	[!#1]C(=O)[CH2][CH]([NH2])C(Cl)(Cl)Cl	PADEL_KR1213
PADEL_KR1214	[!#1]C(=O)[CH2][CH2][CH2][CH2][CH2][CH2][CH2][CH2]C(=O)[!#1]	PADEL_KR1214
PADEL_KR1215	[!#1]C(=O)[CH2][CH2][CH2][CH2][CH2][CH2][CH3]	PADEL_KR1215
PADEL_KR1216	[!#1]C(=O)[CH2][CH2][CH2][CH2][CH2][CH2]C(=O)[!#1]	PADEL_KR1216
PADEL_KR1217	[!#1]C(=O)[CH2][CH2][CH2][CH2][CH2][CH3]	PADEL_KR1217
PADEL_KR1218	[!#1]C(=O)[CH2][CH2][CH2][CH2][CH3]	PADEL_KR1218
PADEL_KR1219	[!#1]C(=O)[CH2][CH2][CH2][CH2]C(=O)[!#1]	PADEL_KR1219
PADEL_KR1220	[!#1]C(=O)[CH2][CH2][CH2][CH2]C(=O)[OH]	PADEL_KR1220
PADEL_KR1221	[!#1]C(=O)[CH2][CH2][CH2][CH3]	PADEL_KR1221
PADEL_KR1222	[!#1]C(=O)[CH2][CH2][CH2]C(=O)[!#1]	PADEL_KR1222
PADEL_KR1223	[!#1]C(=O)[CH2][CH2][CH2]C(=O)[OH]	PADEL_KR1223
PADEL_KR1224	[!#1]C(=O)[CH2][CH2][CH2]c1[cH][cH][cH][cH][cH]1	PADEL_KR1224
PADEL_KR1225	[!#1]C(=O)[CH2][CH2][CH3]	PADEL_KR1225
PADEL_KR1226	[!#1]C(=O)[CH2][CH2]Br	PADEL_KR1226
PADEL_KR1227	[!#1]C(=O)[CH2][CH2]C([CH3])([CH3])C(=O)[!#1]	PADEL_KR1227
PADEL_KR1228	[!#1]C(=O)[CH2][CH2]C(=O)[!#1]	PADEL_KR1228
PADEL_KR1229	[!#1]C(=O)[CH2][CH2]C(=O)[OH]	PADEL_KR1229
PADEL_KR1230	[!#1]C(=O)[CH2][CH2]C(=O)O[CH2]C(=O)[!#1]	PADEL_KR1230
PADEL_KR1231	[!#1]C(=O)[CH2][CH2]C(=O)O[CH3]	PADEL_KR1231
PADEL_KR1232	[!#1]C(=O)[CH2][CH2]c1[cH][cH][cH][cH][cH]1	PADEL_KR1232
PADEL_KR1233	[!#1]C(=O)[CH2][CH2]c1[cH][cH]c([CH3])o1	PADEL_KR1233
PADEL_KR1234	[!#1]C(=O)[CH2][CH2]N([CH2][CH3])[CH2][CH3]	PADEL_KR1234
PADEL_KR1235	[!#1]C(=O)[CH2][CH2]N([CH3])[CH3]	PADEL_KR1235
PADEL_KR1236	[!#1]C(=O)[CH2][CH3]	PADEL_KR1236
PADEL_KR1237	[!#1]C(=O)[CH2][NH][CH2][CH2][OH]	PADEL_KR1237
PADEL_KR1238	[!#1]C(=O)[CH2][NH][CH2][CH3]	PADEL_KR1238
PADEL_KR1239	[!#1]C(=O)[CH2][NH]C([CH3])([CH3])[CH3]	PADEL_KR1239
PADEL_KR1240	[!#1]C(=O)[CH2][NH]C(=O)[!#1]	PADEL_KR1240
PADEL_KR1241	[!#1]C(=O)[CH2][NH2]	PADEL_KR1241
PADEL_KR1242	[!#1]C(=O)[CH2]C([!#1])([OH])C(F)(F)[CH](F)F	PADEL_KR1242
PADEL_KR1243	[!#1]C(=O)[CH2]C([!#1])([OH])C(F)(F)F	PADEL_KR1243
PADEL_KR1244	[!#1]C(=O)[CH2]C(=N[NH]c1[cH][cH][cH][cH][cH]1)[CH3]	PADEL_KR1244
PADEL_KR1245	[!#1]C(=O)[CH2]C(=O)[!#1]	PADEL_KR1245
PADEL_KR1246	[!#1]C(=O)[CH2]C(=O)[CH3]	PADEL_KR1246
PADEL_KR1247	[!#1]C(=O)[CH2]C(=O)O[CH2][CH3]	PADEL_KR1247
PADEL_KR1248	[!#1]C(=O)[CH2]C1([CH2][CH]2[CH2][CH]3[CH2][CH]([CH2]2)[CH2]1)[CH2]3	PADEL_KR1248
PADEL_KR1249	[!#1]C(=O)[CH2]C1(C(=O)c2[cH][cH][cH][cH]c2C1=O)c3[cH][cH][cH][cH][cH]3	PADEL_KR1249
PADEL_KR1250	[!#1]C(=O)[CH2]c1[cH][cH][cH][cH][cH]1	PADEL_KR1250
PADEL_KR1251	[!#1]C(=O)[CH2]c1[cH][cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR1251
PADEL_KR1252	[!#1]C(=O)[CH2]Cl	PADEL_KR1252
PADEL_KR1253	[!#1]C(=O)[CH2]F	PADEL_KR1253
PADEL_KR1254	[!#1]C(=O)[CH2]N([CH2][CH3])[CH2][CH3]	PADEL_KR1254
PADEL_KR1255	[!#1]C(=O)[CH2]N([CH3])[CH3]	PADEL_KR1255
PADEL_KR1256	[!#1]C(=O)[CH2]OC(=O)[!#1]	PADEL_KR1256
PADEL_KR1257	[!#1]C(=O)[CH2]OC(=O)[CH2][CH2][CH2][CH3]	PADEL_KR1257
PADEL_KR1258	[!#1]C(=O)[CH2]OC(=O)[CH2][CH2]C(=O)C(=O)O[CH2]C(=O)[!#1]	PADEL_KR1258
PADEL_KR1259	[!#1]C(=O)[CH2]OC(=O)[CH2][CH2]S(=O)(=O)[!#1]	PADEL_KR1259
PADEL_KR1260	[!#1]C(=O)[CH2]OC(=O)C(=O)O[CH2]C(=O)[!#1]	PADEL_KR1260
PADEL_KR1261	[!#1]C(=O)[CH2]SC(=S)[!#1]	PADEL_KR1261
PADEL_KR1262	[!#1]C(=O)[CH2]SS(=O)(=O)[OH]	PADEL_KR1262
PADEL_KR1263	[!#1]C(=O)[CH3]	PADEL_KR1263
PADEL_KR1264	[!#1]C(=O)[NH][CH]([CH]([CH3])[CH3])C(=O)[OH]	PADEL_KR1264
PADEL_KR1265	[!#1]C(=O)[NH][CH]([CH2][CH]([CH3])[CH3])C(=O)[OH]	PADEL_KR1265
PADEL_KR1266	[!#1]C(=O)[NH][CH]([CH2][CH]([CH3])[CH3])C(=O)O[CH3]	PADEL_KR1266
PADEL_KR1267	[!#1]C(=O)[NH][CH]([CH2][CH2][CH2][NH]C(=[NH])[NH2])C(=O)[NH2]	PADEL_KR1267
PADEL_KR1268	[!#1]C(=O)[NH][CH]([CH2][OH])[CH]([CH3])[CH3]	PADEL_KR1268
PADEL_KR1269	[!#1]C(=O)[NH][CH]([CH2]C(=O)O[CH3])C(=O)O[CH3]	PADEL_KR1269
PADEL_KR1270	[!#1]C(=O)[NH][CH]([CH3])[CH2][CH2][CH2][CH2][CH3]	PADEL_KR1270
PADEL_KR1271	[!#1]C(=O)[NH][CH]([CH3])[CH2][CH3]	PADEL_KR1271
PADEL_KR1272	[!#1]C(=O)[NH][CH]([CH3])[CH3]	PADEL_KR1272
PADEL_KR1273	[!#1]C(=O)[NH][CH]([CH3])C(=O)[OH]	PADEL_KR1273
PADEL_KR1274	[!#1]C(=O)[NH][CH]([NH]C([CH3])([CH3])[CH3])C(Cl)(Cl)Cl	PADEL_KR1274
PADEL_KR1275	[!#1]C(=O)[NH][CH](N([CH2][CH3])[CH2][CH3])C(Cl)(Cl)Cl	PADEL_KR1275
PADEL_KR1276	[!#1]C(=O)[NH][CH2][CH]([CH3])[CH3]	PADEL_KR1276
PADEL_KR1277	[!#1]C(=O)[NH][CH2][CH]=[CH2]	PADEL_KR1277
PADEL_KR1278	[!#1]C(=O)[NH][CH2][CH2][CH2][CH2][CH2][CH2][NH]C(=O)[!#1]	PADEL_KR1278
PADEL_KR1279	[!#1]C(=O)[NH][CH2][CH2][CH2][CH2][CH2][CH3]	PADEL_KR1279
PADEL_KR1280	[!#1]C(=O)[NH][CH2][CH2][CH2][CH2][CH2]C(=O)[OH]	PADEL_KR1280
PADEL_KR1281	[!#1]C(=O)[NH][CH2][CH2][CH2][CH2][CH3]	PADEL_KR1281
PADEL_KR1282	[!#1]C(=O)[NH][CH2][CH2][CH2][CH2][NH]C(=O)[!#1]	PADEL_KR1282
PADEL_KR1283	[!#1]C(=O)[NH][CH2][CH2][CH2][CH3]	PADEL_KR1283
PADEL_KR1284	[!#1]C(=O)[NH][CH2][CH2][CH2][OH]	PADEL_KR1284
PADEL_KR1285	[!#1]C(=O)[NH][CH2][CH2][CH2]C(=O)[OH]	PADEL_KR1285
PADEL_KR1286	[!#1]C(=O)[NH][CH2][CH2][CH2]N([CH3])[CH3]	PADEL_KR1286
PADEL_KR1287	[!#1]C(=O)[NH][CH2][CH2][CH3]	PADEL_KR1287
PADEL_KR1288	[!#1]C(=O)[NH][CH2][CH2][NH]C(=O)[!#1]	PADEL_KR1288
PADEL_KR1289	[!#1]C(=O)[NH][CH2][CH2][OH]	PADEL_KR1289
PADEL_KR1290	[!#1]C(=O)[NH][CH2][CH2]C(=O)[OH]	PADEL_KR1290
PADEL_KR1291	[!#1]C(=O)[NH][CH2][CH2]N([CH2][CH3])[CH2][CH3]	PADEL_KR1291
PADEL_KR1292	[!#1]C(=O)[NH][CH2][CH2]OC(=O)[!#1]	PADEL_KR1292
PADEL_KR1293	[!#1]C(=O)[NH][CH2][CH2]OC(=O)[CH3]	PADEL_KR1293
PADEL_KR1294	[!#1]C(=O)[NH][CH2][CH3]	PADEL_KR1294
PADEL_KR1295	[!#1]C(=O)[NH][CH2]C(=O)[OH]	PADEL_KR1295
PADEL_KR1296	[!#1]C(=O)[NH][CH2]C(=O)O[CH2][CH3]	PADEL_KR1296
PADEL_KR1297	[!#1]C(=O)[NH][CH2]C(=O)O[CH3]	PADEL_KR1297
PADEL_KR1298	[!#1]C(=O)[NH][CH2]OC(=O)[!#1]	PADEL_KR1298
PADEL_KR1299	[!#1]C(=O)[NH][CH3]	PADEL_KR1299
PADEL_KR1300	[!#1]C(=O)[NH][NH]C(=O)[!#1]	PADEL_KR1300
PADEL_KR1301	[!#1]C(=O)[NH][NH]C(=O)[CH]=[CH]C(=O)[OH]	PADEL_KR1301
PADEL_KR1302	[!#1]C(=O)[NH][NH]C(=O)[CH2][CH2][CH2][CH2][CH2][CH2][CH3]	PADEL_KR1302
PADEL_KR1303	[!#1]C(=O)[NH][NH]C(=O)[CH2][CH2]C(=O)[OH]	PADEL_KR1303
PADEL_KR1304	[!#1]C(=O)[NH][NH]C(=O)[CH3]	PADEL_KR1304
PADEL_KR1305	[!#1]C(=O)[NH][NH]C(=O)C(F)(F)F	PADEL_KR1305
PADEL_KR1306	[!#1]C(=O)[NH][NH]C(=S)[NH]C(=O)[!#1]	PADEL_KR1306
PADEL_KR1307	[!#1]C(=O)[NH][NH]C(=S)[NH2]	PADEL_KR1307
PADEL_KR1308	[!#1]C(=O)[NH][NH]S(=O)(=O)[!#1]	PADEL_KR1308
PADEL_KR1309	[!#1]C(=O)[NH][NH2]	PADEL_KR1309
PADEL_KR1310	[!#1]C(=O)[NH][OH]	PADEL_KR1310
PADEL_KR1311	[!#1]C(=O)[NH]C([!#1])([!#1])[CH3]	PADEL_KR1311
PADEL_KR1312	[!#1]C(=O)[NH]C([CH2][OH])([CH2][OH])[CH2][OH]	PADEL_KR1312
PADEL_KR1313	[!#1]C(=O)[NH]C([CH3])([CH3])[CH3]	PADEL_KR1313
PADEL_KR1314	[!#1]C(=O)[NH]C(=S)[!#1]	PADEL_KR1314
PADEL_KR1315	[!#1]C(=O)[NH]c1[cH][cH][cH][cH][cH]1	PADEL_KR1315
PADEL_KR1316	[!#1]C(=O)[NH]c1[cH][cH][cH]c(Cl)[cH]1	PADEL_KR1316
PADEL_KR1317	[!#1]C(=O)[NH]c1[cH][cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR1317
PADEL_KR1318	[!#1]C(=O)[NH]c1[cH][cH]c([cH][cH]1)S(=O)(=O)[!#1]	PADEL_KR1318
PADEL_KR1319	[!#1]C(=O)[NH]c1[cH][cH]c(Cl)[cH][cH]1	PADEL_KR1319
PADEL_KR1320	[!#1]C(=O)[NH]c1[cH][cH]c(Cl)c(Cl)[cH]1	PADEL_KR1320
PADEL_KR1321	[!#1]C(=O)[NH]c1nc([CH3])[cH]c([CH3])n1	PADEL_KR1321
PADEL_KR1322	[!#1]C(=O)[NH]c1nc([CH3])nc(O[CH3])n1	PADEL_KR1322
PADEL_KR1323	[!#1]C(=O)[NH]N=[CH][CH]=[CH]c1[cH][cH][cH][cH][cH]1	PADEL_KR1323
PADEL_KR1324	[!#1]C(=O)[NH]N=[CH][CH]=N[NH]C(=O)[!#1]	PADEL_KR1324
PADEL_KR1325	[!#1]C(=O)[NH]N=[CH][CH2][CH2][CH3]	PADEL_KR1325
PADEL_KR1326	[!#1]C(=O)[NH]N=[CH]c1[cH][cH][cH][cH][cH]1	PADEL_KR1326
PADEL_KR1327	[!#1]C(=O)[NH]N=[CH]c1[cH][cH][cH][cH]c1[N+](=O)[O-]	PADEL_KR1327
PADEL_KR1328	[!#1]C(=O)[NH]N=[CH]c1[cH][cH][cH][cH]c1[OH]	PADEL_KR1328
PADEL_KR1329	[!#1]C(=O)[NH]N=[CH]c1[cH][cH][cH][cH]c1Cl	PADEL_KR1329
PADEL_KR1330	[!#1]C(=O)[NH]N=[CH]c1[cH][cH][cH][cH]c1F	PADEL_KR1330
PADEL_KR1331	[!#1]C(=O)[NH]N=[CH]c1[cH][cH][cH][cH]c1O[CH3]	PADEL_KR1331
PADEL_KR1332	[!#1]C(=O)[NH]N=[CH]c1[cH][cH][cH][nH]1	PADEL_KR1332
PADEL_KR1333	[!#1]C(=O)[NH]N=[CH]c1[cH][cH][cH]c([cH]1)[N+](=O)[O-]	PADEL_KR1333
PADEL_KR1334	[!#1]C(=O)[NH]N=[CH]c1[cH][cH][cH]c([CH2][CH]=[CH2])c1[OH]	PADEL_KR1334
PADEL_KR1335	[!#1]C(=O)[NH]N=[CH]c1[cH][cH][cH]n[cH]1	PADEL_KR1335
PADEL_KR1336	[!#1]C(=O)[NH]N=[CH]c1[cH][cH][cH]o1	PADEL_KR1336
PADEL_KR1337	[!#1]C(=O)[NH]N=[CH]c1[cH][cH][cH]s1	PADEL_KR1337
PADEL_KR1338	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c([!#1])[cH][cH]1	PADEL_KR1338
PADEL_KR1339	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c([!#1])[cH]c1[OH]	PADEL_KR1339
PADEL_KR1340	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c([cH][cH]1)[N+](=O)[O-]	PADEL_KR1340
PADEL_KR1341	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c([cH][cH]1)c2[cH][cH][cH][cH][cH]2	PADEL_KR1341
PADEL_KR1342	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c([cH][cH]1)N([CH3])[CH3]	PADEL_KR1342
PADEL_KR1343	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c([CH3])o1	PADEL_KR1343
PADEL_KR1344	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c([OH])[cH][cH]1	PADEL_KR1344
PADEL_KR1345	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c([OH])c(O[CH3])[cH]1	PADEL_KR1345
PADEL_KR1346	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c(Br)[cH][cH]1	PADEL_KR1346
PADEL_KR1347	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c(Cl)[cH][cH]1	PADEL_KR1347
PADEL_KR1348	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c(Cl)[cH]c1Cl	PADEL_KR1348
PADEL_KR1349	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c(F)[cH][cH]1	PADEL_KR1349
PADEL_KR1350	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c(O[CH3])[cH][cH]1	PADEL_KR1350
PADEL_KR1351	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c(O[CH3])[cH]c1O[CH3]	PADEL_KR1351
PADEL_KR1352	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c(O[CH3])c(O[CH3])[cH]1	PADEL_KR1352
PADEL_KR1353	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c(o1)[N+](=O)[O-]	PADEL_KR1353
PADEL_KR1354	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c(s1)[N+](=O)[O-]	PADEL_KR1354
PADEL_KR1355	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c2n([CH2][CH3])c3[cH][cH][cH][cH]c3c2[cH]1	PADEL_KR1355
PADEL_KR1356	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]c2O[CH2]Oc2[cH]1	PADEL_KR1356
PADEL_KR1357	[!#1]C(=O)[NH]N=[CH]c1[cH][cH]n[cH][cH]1	PADEL_KR1357
PADEL_KR1358	[!#1]C(=O)[NH]N=[CH]c1[cH][nH]c2[cH][cH][cH][cH]c12	PADEL_KR1358
PADEL_KR1359	[!#1]C(=O)[NH]N=[CH]c1[cH]c([cH][cH]c1[OH])[N+](=O)[O-]	PADEL_KR1359
PADEL_KR1360	[!#1]C(=O)[NH]N=[CH]c1[cH]c([CH3])[cH][cH]c1[OH]	PADEL_KR1360
PADEL_KR1361	[!#1]C(=O)[NH]N=[CH]c1[cH]c(Cl)[cH][cH]c1[OH]	PADEL_KR1361
PADEL_KR1362	[!#1]C(=O)[NH]N=[CH]c1[cH]c(Cl)[cH]c(Cl)c1O[CH3]	PADEL_KR1362
PADEL_KR1363	[!#1]C(=O)[NH]N=[CH]c1[cH]c2O[CH2]Oc2[cH]c1[N+](=O)[O-]	PADEL_KR1363
PADEL_KR1364	[!#1]C(=O)[NH]N=[CH]c1[cH]c2O[CH2]Oc2[cH]c1Br	PADEL_KR1364
PADEL_KR1365	[!#1]C(=O)[NH]N=[CH]c1c([OH])[cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR1365
PADEL_KR1366	[!#1]C(=O)[NH]N=[CH]c1nc2[cH][cH][cH][cH]c2[nH]1	PADEL_KR1366
PADEL_KR1367	[!#1]C(=O)[NH]N=C([!#1])[CH2][CH2][CH2][CH2][CH3]	PADEL_KR1367
PADEL_KR1368	[!#1]C(=O)[NH]N=C([!#1])[CH2][CH2][CH2][CH3]	PADEL_KR1368
PADEL_KR1369	[!#1]C(=O)[NH]N=C([!#1])[CH2][CH2][CH3]	PADEL_KR1369
PADEL_KR1370	[!#1]C(=O)[NH]N=C([!#1])[CH2][CH3]	PADEL_KR1370
PADEL_KR1371	[!#1]C(=O)[NH]N=C([CH3])[CH]=[CH]c1[cH][cH][cH][cH][cH]1	PADEL_KR1371
PADEL_KR1372	[!#1]C(=O)[NH]N=C([CH3])[CH]1[CH2][CH2]1	PADEL_KR1372
PADEL_KR1373	[!#1]C(=O)[NH]N=C([CH3])[CH2][CH]([CH3])[CH3]	PADEL_KR1373
PADEL_KR1374	[!#1]C(=O)[NH]N=C([CH3])[CH2][CH2][CH]=[CH2]	PADEL_KR1374
PADEL_KR1375	[!#1]C(=O)[NH]N=C([CH3])[CH2][CH2][CH2][CH3]	PADEL_KR1375
PADEL_KR1376	[!#1]C(=O)[NH]N=C([CH3])[CH2][NH]C(=O)[CH3]	PADEL_KR1376
PADEL_KR1377	[!#1]C(=O)[NH]N=C([CH3])[CH2]C(=O)[CH3]	PADEL_KR1377
PADEL_KR1378	[!#1]C(=O)[NH]N=C([CH3])[CH3]	PADEL_KR1378
PADEL_KR1379	[!#1]C(=O)[NH]N=C([CH3])C(=N[OH])[CH3]	PADEL_KR1379
PADEL_KR1380	[!#1]C(=O)[NH]N=C([CH3])c1[cH][cH][cH][cH][cH]1	PADEL_KR1380
PADEL_KR1381	[!#1]C(=O)[NH]N=C([CH3])c1[cH][cH][cH][cH]c1[OH]	PADEL_KR1381
PADEL_KR1382	[!#1]C(=O)[NH]N=C([CH3])c1[cH][cH][cH]c([cH]1)[N+](=O)[O-]	PADEL_KR1382
PADEL_KR1383	[!#1]C(=O)[NH]N=C([CH3])c1[cH][cH][cH]c([NH2])[cH]1	PADEL_KR1383
PADEL_KR1384	[!#1]C(=O)[NH]N=C([CH3])c1[cH][cH][cH]o1	PADEL_KR1384
PADEL_KR1385	[!#1]C(=O)[NH]N=C([CH3])c1[cH][cH]c([!#1])[cH][cH]1	PADEL_KR1385
PADEL_KR1386	[!#1]C(=O)[NH]N=C([CH3])c1[cH][cH]c([cH][cH]1)[N+](=O)[O-]	PADEL_KR1386
PADEL_KR1387	[!#1]C(=O)[NH]N=C([CH3])c1[cH][cH]c([cH][cH]1)c2[cH][cH][cH][cH][cH]2	PADEL_KR1387
PADEL_KR1388	[!#1]C(=O)[NH]N=C([CH3])c1[cH][cH]c([NH2])[cH][cH]1	PADEL_KR1388
PADEL_KR1389	[!#1]C(=O)[NH]N=C([CH3])c1[cH][cH]c([OH])[cH][cH]1	PADEL_KR1389
PADEL_KR1390	[!#1]C(=O)[NH]N=C([CH3])c1[cH][cH]c(Br)[cH][cH]1	PADEL_KR1390
PADEL_KR1391	[!#1]C(=O)[NH]N=C([CH3])c1[cH][cH]c(Cl)[cH][cH]1	PADEL_KR1391
PADEL_KR1392	[!#1]C(=O)[NH]N=C([CH3])c1[cH][cH]c(Cl)s1	PADEL_KR1392
PADEL_KR1393	[!#1]C(=O)[NH]N=C([CH3])c1[cH][cH]c(F)[cH][cH]1	PADEL_KR1393
PADEL_KR1394	[!#1]C(=O)[NH]N=C([CH3])c1[cH][cH]c(O[CH3])[cH][cH]1	PADEL_KR1394
PADEL_KR1395	[!#1]C(=O)[NH]N=C([CH3])c1[cH][cH]c(O[CH3])[cH]c1O[CH3]	PADEL_KR1395
PADEL_KR1396	[!#1]C(=O)[NH]N=C([CH3])c1[cH]c([OH])[cH][cH]c1[OH]	PADEL_KR1396
PADEL_KR1397	[!#1]C(=O)[NH]N=C1[CH2][CH2][CH2][CH2][CH2]1	PADEL_KR1397
PADEL_KR1398	[!#1]C(=O)[NH]N=C1[CH2][CH2][CH2][CH2]1	PADEL_KR1398
PADEL_KR1399	[!#1]C(=O)[NH]N=C1[CH2]C(=O)[CH2]C([CH3])([CH3])[CH2]1	PADEL_KR1399
PADEL_KR1400	[!#1]C(=O)[NH]N=C1C(=O)[NH]c2[cH][cH][cH][cH]c12	PADEL_KR1400
PADEL_KR1401	[!#1]C(=O)[NH]N=C1C(=O)[NH]c2[cH][cH]c([!#1])[cH]c12	PADEL_KR1401
PADEL_KR1402	[!#1]C(=O)[NH]N=c1c(=O)c2[cH][cH][cH][cH]c2c1=O	PADEL_KR1402
PADEL_KR1403	[!#1]C(=O)[NH]N=C1c2nn([!#1])nc2C(=N[NH]C(=O)[!#1])c3nn([!#1])nc13	PADEL_KR1403
PADEL_KR1404	[!#1]C(=O)[NH]S(=O)(=O)[!#1]	PADEL_KR1404
PADEL_KR1405	[!#1]C(=O)[NH2]	PADEL_KR1405
PADEL_KR1406	[!#1]C(=O)[OH]	PADEL_KR1406
PADEL_KR1407	[!#1]C(=O)C([!#1])([!#1])[CH3]	PADEL_KR1407
PADEL_KR1408	[!#1]C(=O)C([!#1])([!#1])[OH]	PADEL_KR1408
PADEL_KR1409	[!#1]C(=O)C([!#1])([!#1])C#N	PADEL_KR1409
PADEL_KR1410	[!#1]C(=O)C([!#1])([!#1])C(=O)[!#1]	PADEL_KR1410
PADEL_KR1411	[!#1]C(=O)C([CH2][CH3])([CH2][CH3])C(=O)[!#1]	PADEL_KR1411
PADEL_KR1412	[!#1]C(=O)C([CH3])([CH3])[CH3]	PADEL_KR1412
PADEL_KR1413	[!#1]C(=O)C([OH])(c1[cH][cH][cH][cH][cH]1)c2[cH][cH][cH][cH][cH]2	PADEL_KR1413
PADEL_KR1414	[!#1]C(=O)C([OH])(c1[cH][cH]c(Br)[cH][cH]1)c2[cH][cH]c(Br)[cH][cH]2	PADEL_KR1414
PADEL_KR1415	[!#1]C(=O)C(=N[NH]c1[cH][cH]c([cH][cH]1)[N+](=O)[O-])C(=O)[!#1]	PADEL_KR1415
PADEL_KR1416	[!#1]C(=O)C(=N[NH]c1[cH][cH]c([cH][cH]1)S(=O)(=O)[OH])C(=O)[!#1]	PADEL_KR1416
PADEL_KR1417	[!#1]C(=O)C(=N[OH])C(=O)O[CH2][CH3]	PADEL_KR1417
PADEL_KR1418	[!#1]C(=O)C(=O)[!#1]	PADEL_KR1418
PADEL_KR1419	[!#1]C(=O)C(Cl)(Cl)Cl	PADEL_KR1419
PADEL_KR1420	[!#1]C(=O)C(F)(F)C(F)(F)F	PADEL_KR1420
PADEL_KR1421	[!#1]C(=O)C(F)(F)F	PADEL_KR1421
PADEL_KR1422	[!#1]C(=O)C(F)(F)OC(F)(F)C(F)(F)OC(F)(F)F	PADEL_KR1422
PADEL_KR1423	[!#1]C(=O)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F	PADEL_KR1423
PADEL_KR1424	[!#1]C(=O)C1([CH2][CH]2[CH2][CH]3[CH2][CH]([CH2]2)[CH2]1)[CH2]3	PADEL_KR1424
PADEL_KR1425	[!#1]C(=O)C1([CH2][CH]2[CH2][CH]3[CH2]1)[CH2][CH]([CH2]2)[CH2][CH2]3	PADEL_KR1425
PADEL_KR1426	[!#1]C(=O)c1[cH][cH][cH][cH][cH]1	PADEL_KR1426
PADEL_KR1427	[!#1]C(=O)c1[cH][cH][cH][cH]c1[!#1]	PADEL_KR1427
PADEL_KR1428	[!#1]C(=O)c1[cH][cH][cH][cH]c1[CH3]	PADEL_KR1428
PADEL_KR1429	[!#1]C(=O)c1[cH][cH][cH][cH]c1[N+](=O)[O-]	PADEL_KR1429
PADEL_KR1430	[!#1]C(=O)c1[cH][cH][cH][cH]c1[OH]	PADEL_KR1430
PADEL_KR1431	[!#1]C(=O)c1[cH][cH][cH][cH]c1Br	PADEL_KR1431
PADEL_KR1432	[!#1]C(=O)c1[cH][cH][cH][cH]c1C(=O)[!#1]	PADEL_KR1432
PADEL_KR1433	[!#1]C(=O)c1[cH][cH][cH][cH]c1C(=O)[OH]	PADEL_KR1433
PADEL_KR1434	[!#1]C(=O)c1[cH][cH][cH][cH]c1Cl	PADEL_KR1434
PADEL_KR1435	[!#1]C(=O)c1[cH][cH][cH][cH]c1F	PADEL_KR1435
PADEL_KR1436	[!#1]C(=O)c1[cH][cH][cH][cH]c1I	PADEL_KR1436
PADEL_KR1437	[!#1]C(=O)c1[cH][cH][cH][cH]n1	PADEL_KR1437
PADEL_KR1438	[!#1]C(=O)c1[cH][cH][cH]c([!#1])[cH]1	PADEL_KR1438
PADEL_KR1439	[!#1]C(=O)c1[cH][cH][cH]c([cH]1)[N+](=O)[O-]	PADEL_KR1439
PADEL_KR1440	[!#1]C(=O)c1[cH][cH][cH]c([cH]1)C(=O)[!#1]	PADEL_KR1440
PADEL_KR1441	[!#1]C(=O)c1[cH][cH][cH]c([cH]1)S(=O)(=O)[!#1]	PADEL_KR1441
PADEL_KR1442	[!#1]C(=O)c1[cH][cH][cH]c([CH3])[cH]1	PADEL_KR1442
PADEL_KR1443	[!#1]C(=O)c1[cH][cH][cH]c(Br)[cH]1	PADEL_KR1443
PADEL_KR1444	[!#1]C(=O)c1[cH][cH][cH]c(Cl)[cH]1	PADEL_KR1444
PADEL_KR1445	[!#1]C(=O)c1[cH][cH][cH]c(F)[cH]1	PADEL_KR1445
PADEL_KR1446	[!#1]C(=O)c1[cH][cH][cH]c(I)[cH]1	PADEL_KR1446
PADEL_KR1447	[!#1]C(=O)c1[cH][cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR1447
PADEL_KR1448	[!#1]C(=O)c1[cH][cH][cH]n[cH]1	PADEL_KR1448
PADEL_KR1449	[!#1]C(=O)c1[cH][cH][cH]o1	PADEL_KR1449
PADEL_KR1450	[!#1]C(=O)c1[cH][cH][cH]s1	PADEL_KR1450
PADEL_KR1451	[!#1]C(=O)c1[cH][cH][n+]([O-])[cH][cH]1	PADEL_KR1451
PADEL_KR1452	[!#1]C(=O)c1[cH][cH]c([!#1])[cH][cH]1	PADEL_KR1452
PADEL_KR1453	[!#1]C(=O)c1[cH][cH]c([!#1])c([cH]1)[N+](=O)[O-]	PADEL_KR1453
PADEL_KR1454	[!#1]C(=O)c1[cH][cH]c([cH][cH]1)[N+](=O)[O-]	PADEL_KR1454
PADEL_KR1455	[!#1]C(=O)c1[cH][cH]c([cH][cH]1)C([CH3])([CH3])[CH3]	PADEL_KR1455
PADEL_KR1456	[!#1]C(=O)c1[cH][cH]c([cH][cH]1)C(=O)[!#1]	PADEL_KR1456
PADEL_KR1457	[!#1]C(=O)c1[cH][cH]c([cH][cH]1)c2[cH][cH][cH][cH][cH]2	PADEL_KR1457
PADEL_KR1458	[!#1]C(=O)c1[cH][cH]c([cH][cH]1)S(=O)(=O)[!#1]	PADEL_KR1458
PADEL_KR1459	[!#1]C(=O)c1[cH][cH]c([cH]c1[N+](=O)[O-])[N+](=O)[O-]	PADEL_KR1459
PADEL_KR1460	[!#1]C(=O)c1[cH][cH]c([cH]c1C(=O)[OH])[N+](=O)[O-]	PADEL_KR1460
PADEL_KR1461	[!#1]C(=O)c1[cH][cH]c([CH3])[cH][cH]1	PADEL_KR1461
PADEL_KR1462	[!#1]C(=O)c1[cH][cH]c([CH3])c([cH]1)S(=O)(=O)[!#1]	PADEL_KR1462
PADEL_KR1463	[!#1]C(=O)c1[cH][cH]c([OH])[cH][cH]1	PADEL_KR1463
PADEL_KR1464	[!#1]C(=O)c1[cH][cH]c(Br)[cH][cH]1	PADEL_KR1464
PADEL_KR1465	[!#1]C(=O)c1[cH][cH]c(Br)c([cH]1)[N+](=O)[O-]	PADEL_KR1465
PADEL_KR1466	[!#1]C(=O)c1[cH][cH]c(Br)o1	PADEL_KR1466
PADEL_KR1467	[!#1]C(=O)c1[cH][cH]c(Cl)[cH][cH]1	PADEL_KR1467
PADEL_KR1468	[!#1]C(=O)c1[cH][cH]c(Cl)[cH]c1Cl	PADEL_KR1468
PADEL_KR1469	[!#1]C(=O)c1[cH][cH]c(Cl)c([cH]1)[N+](=O)[O-]	PADEL_KR1469
PADEL_KR1470	[!#1]C(=O)c1[cH][cH]c(Cl)c(Cl)[cH]1	PADEL_KR1470
PADEL_KR1471	[!#1]C(=O)c1[cH][cH]c(F)[cH][cH]1	PADEL_KR1471
PADEL_KR1472	[!#1]C(=O)c1[cH][cH]c(F)c(F)[cH]1	PADEL_KR1472
PADEL_KR1473	[!#1]C(=O)c1[cH][cH]c(o1)[N+](=O)[O-]	PADEL_KR1473
PADEL_KR1474	[!#1]C(=O)c1[cH][cH]c2[cH][cH][cH][cH]c2[cH]1	PADEL_KR1474
PADEL_KR1475	[!#1]C(=O)c1[cH][cH]c2n([!#1])c([CH3])c([CH3])c2[cH]1	PADEL_KR1475
PADEL_KR1476	[!#1]C(=O)c1[cH][cH]n[cH][cH]1	PADEL_KR1476
PADEL_KR1477	[!#1]C(=O)c1[cH]c([cH][cH]c1Cl)[N+](=O)[O-]	PADEL_KR1477
PADEL_KR1478	[!#1]C(=O)c1[cH]c([cH]c([cH]1)[N+](=O)[O-])[N+](=O)[O-]	PADEL_KR1478
PADEL_KR1479	[!#1]C(=O)c1[cH]c([cH]c([cH]1)C([CH3])([CH3])[CH3])C([CH3])([CH3])[CH3]	PADEL_KR1479
PADEL_KR1480	[!#1]C(=O)c1[cH]c([N+](=O)[O-])c([CH3])c([cH]1)[N+](=O)[O-]	PADEL_KR1480
PADEL_KR1481	[!#1]C(=O)c1[cH]c(Cl)[cH][cH]c1[OH]	PADEL_KR1481
PADEL_KR1482	[!#1]C(=O)c1[cH]c(Cl)[cH]c(Cl)[cH]1	PADEL_KR1482
PADEL_KR1483	[!#1]C(=O)c1[cH]c2[cH][cH][cH][cH]c2oc1=O	PADEL_KR1483
PADEL_KR1484	[!#1]C(=O)c1[cH]n([!#1])nc1[!#1]	PADEL_KR1484
PADEL_KR1485	[!#1]C(=O)c1c([!#1])[cH]nn1[!#1]	PADEL_KR1485
PADEL_KR1486	[!#1]C(=O)c1c([!#1])n([!#1])c2nc3[cH][cH][cH][cH]c3nc12	PADEL_KR1486
PADEL_KR1487	[!#1]C(=O)c1c([cH][cH][cH]c1[N+](=O)[O-])C(=O)[OH]	PADEL_KR1487
PADEL_KR1488	[!#1]C(=O)c1c([cH]nn1[!#1])[N+](=O)[O-]	PADEL_KR1488
PADEL_KR1489	[!#1]C(=O)c1c([OH])c2[cH][cH][cH][cH]c2oc1=O	PADEL_KR1489
PADEL_KR1490	[!#1]C(=O)c1c(F)[cH][cH][cH]c1F	PADEL_KR1490
PADEL_KR1491	[!#1]C(=O)c1c(n[cH]n1[!#1])[N+](=O)[O-]	PADEL_KR1491
PADEL_KR1492	[!#1]C(=O)c1n[cH][cH]nc1C(=O)[OH]	PADEL_KR1492
PADEL_KR1493	[!#1]C(=O)c1nn([!#1])[cH]c1Br	PADEL_KR1493
PADEL_KR1494	[!#1]C(=O)c1sc([!#1])nc1[!#1]	PADEL_KR1494
PADEL_KR1495	[!#1]C(=O)c1sc2[cH][cH][cH][cH]c2c1Cl	PADEL_KR1495
PADEL_KR1496	[!#1]C(=O)N([CH]([CH3])[CH3])[CH]([CH3])[CH3]	PADEL_KR1496
PADEL_KR1497	[!#1]C(=O)N([CH2][CH2][CH2][CH2][CH3])[CH2][CH2][CH2][CH2][CH3]	PADEL_KR1497
PADEL_KR1498	[!#1]C(=O)N([CH2][CH2]C(=O)[OH])[CH2]C(=O)[OH]	PADEL_KR1498
PADEL_KR1499	[!#1]C(=O)N([CH2][CH3])[CH2][CH3]	PADEL_KR1499
PADEL_KR1500	[!#1]C(=O)N([CH3])[CH3]	PADEL_KR1500
PADEL_KR1501	[!#1]C(=O)n1[cH]nc2[cH][cH][cH][cH]c12	PADEL_KR1501
PADEL_KR1502	[!#1]C(=O)N1[CH2][CH2][CH2][CH2][CH2][CH2]1	PADEL_KR1502
PADEL_KR1503	[!#1]C(=O)N1[CH2][CH2][CH2][CH2][CH2]1	PADEL_KR1503
PADEL_KR1504	[!#1]C(=O)N1[CH2][CH2][CH2][CH2]1	PADEL_KR1504
PADEL_KR1505	[!#1]C(=O)N1[CH2][CH2]c2[cH][cH][cH][cH]c12	PADEL_KR1505
PADEL_KR1506	[!#1]C(=O)N1[CH2][CH2]O[CH2][CH2]1	PADEL_KR1506
PADEL_KR1507	[!#1]C(=O)n1nnc2[cH][cH][cH][cH]c12	PADEL_KR1507
PADEL_KR1508	[!#1]C(=O)O[CH]([CH3])[CH3]	PADEL_KR1508
PADEL_KR1509	[!#1]C(=O)O[CH]([CH3])C(=C(Cl)Cl)Cl	PADEL_KR1509
PADEL_KR1510	[!#1]C(=O)O[CH2][CH]([CH3])[CH3]	PADEL_KR1510
PADEL_KR1511	[!#1]C(=O)O[CH2][CH2][CH2][CH2][CH2][CH3]	PADEL_KR1511
PADEL_KR1512	[!#1]C(=O)O[CH2][CH2][CH2][CH2][CH3]	PADEL_KR1512
PADEL_KR1513	[!#1]C(=O)O[CH2][CH2][CH2][CH3]	PADEL_KR1513
PADEL_KR1514	[!#1]C(=O)O[CH2][CH2][CH2]N([CH3])[CH3]	PADEL_KR1514
PADEL_KR1515	[!#1]C(=O)O[CH2][CH2][CH3]	PADEL_KR1515
PADEL_KR1516	[!#1]C(=O)O[CH2][CH2][NH2]	PADEL_KR1516
PADEL_KR1517	[!#1]C(=O)O[CH2][CH2][OH]	PADEL_KR1517
PADEL_KR1518	[!#1]C(=O)O[CH2][CH2]N([CH2][CH3])[CH2][CH3]	PADEL_KR1518
PADEL_KR1519	[!#1]C(=O)O[CH2][CH2]N([CH3])[CH3]	PADEL_KR1519
PADEL_KR1520	[!#1]C(=O)O[CH2][CH3]	PADEL_KR1520
PADEL_KR1521	[!#1]C(=O)O[CH2]C#[CH]	PADEL_KR1521
PADEL_KR1522	[!#1]C(=O)O[CH2]C(=C(Cl)Cl)Cl	PADEL_KR1522
PADEL_KR1523	[!#1]C(=O)O[CH2]C(F)(F)C(F)(F)F	PADEL_KR1523
PADEL_KR1524	[!#1]C(=O)O[CH3]	PADEL_KR1524
PADEL_KR1525	[!#1]C(=O)OC([CH3])([CH3])[CH3]	PADEL_KR1525
PADEL_KR1526	[!#1]C(=O)ON=[CH]c1[cH][cH]c(Br)[cH][cH]1	PADEL_KR1526
PADEL_KR1527	[!#1]C(=O)ON=C([CH3])C([CH3])([CH3])[CH3]	PADEL_KR1527
PADEL_KR1528	[!#1]C(=O)ON=C([CH3])c1[cH][cH][cH][cH][cH]1	PADEL_KR1528
PADEL_KR1529	[!#1]C(=S)[NH][CH2]C(=[CH2])[CH3]	PADEL_KR1529
PADEL_KR1530	[!#1]C(=S)[NH2]	PADEL_KR1530
PADEL_KR1531	[!#1]C(=S)S[CH2][CH2]C(=O)[OH]	PADEL_KR1531
PADEL_KR1532	[!#1]C(Cl)(Cl)Cl	PADEL_KR1532
PADEL_KR1533	[!#1]C(F)(F)[CH](F)F	PADEL_KR1533
PADEL_KR1534	[!#1]C(F)(F)C(F)(F)[CH](F)F	PADEL_KR1534
PADEL_KR1535	[!#1]C(F)(F)C(F)(F)F	PADEL_KR1535
PADEL_KR1536	[!#1]C(F)(F)F	PADEL_KR1536
PADEL_KR1537	[!#1]C1([!#1])[CH]2[CH2][CH2]C([CH3])(C1=O)C2([CH3])[CH3]	PADEL_KR1537
PADEL_KR1538	[!#1]C1([!#1])[CH2][CH2][CH2][CH2][CH2]1	PADEL_KR1538
PADEL_KR1539	[!#1]C1([!#1])[CH2][CH2][CH2][CH2]1	PADEL_KR1539
PADEL_KR1540	[!#1]C1([!#1])C(=NN(C1=O)c2[cH][cH]c([cH][cH]2)[N+](=O)[O-])[CH3]	PADEL_KR1540
PADEL_KR1541	[!#1]C1([!#1])C(=O)[CH2]C([CH3])([CH3])[CH2]C1=O	PADEL_KR1541
PADEL_KR1542	[!#1]C1([!#1])C(=O)c2[cH][cH][cH][cH]c2C1=O	PADEL_KR1542
PADEL_KR1543	[!#1]C1([!#1])C(=O)N(N=C1c2[cH][cH][cH][cH][cH]2)c3[cH][cH]c([cH][cH]3)[N+](=O)[O-]	PADEL_KR1543
PADEL_KR1544	[!#1]C1([!#1])C(=O)OC([CH3])([CH3])OC1=O	PADEL_KR1544
PADEL_KR1545	[!#1]C1([!#1])S(c2[cH][cH][cH][cH]c2C1=O)	PADEL_KR1545
PADEL_KR1546	[!#1]C1([CH2][CH]2[CH2][CH]3[CH2][CH]([CH2]2)[CH2]1)[CH2]3	PADEL_KR1546
PADEL_KR1547	[!#1]C1([CH2][CH]2[CH2][CH]3[CH2][CH]2[CH2]1)[CH2]3	PADEL_KR1547
PADEL_KR1548	[!#1]C1([CH2][CH]2[CH2][CH]3[CH2]1)[CH2][CH]([CH2]2)[CH2][CH2]3	PADEL_KR1548
PADEL_KR1549	[!#1]C1([CH2][CH]2[CH2][CH]3[CH2]1)[CH2]C([!#1])([CH2]2)[CH2]3	PADEL_KR1549
PADEL_KR1550	[!#1]C1([CH2][CH]2[CH2][CH]3[CH2]1)[CH2]C([OH])([CH2]2)[CH2]3	PADEL_KR1550
PADEL_KR1551	[!#1]C1([CH2][CH3])C(=[NH])[NH]C(=O)[NH]C1=O	PADEL_KR1551
PADEL_KR1552	[!#1]C1([CH2]N2[CH2]N3[CH2]1)C(=O)C([!#1])([CH2]2)[CH2]3	PADEL_KR1552
PADEL_KR1553	[!#1]C1([CH3])O[CH2][CH2]O1	PADEL_KR1553
PADEL_KR1554	[!#1]C1([OH])[CH2][CH2][CH2][CH2][CH2]1	PADEL_KR1554
PADEL_KR1555	[!#1]C1([OH])[CH2][CH2][CH2][CH2]1	PADEL_KR1555
PADEL_KR1556	[!#1]C1([OH])C(=O)[NH]c2[cH][cH][cH][cH]c21	PADEL_KR1556
PADEL_KR1557	[!#1]C1([OH])N(C(=O)[NH]c2[cH][cH][cH][cH]c21)c3[cH][cH][cH][cH][cH]3	PADEL_KR1557
PADEL_KR1558	[!#1]C1(C(=O)c2[cH][cH][cH][cH]c2C1=O)c3[cH][cH][cH][cH][cH]3	PADEL_KR1558
PADEL_KR1559	[!#1]C1(C(=O)N(c2[cH][cH][cH][cH]c21)c3[cH][cH][cH][cH][cH]3)C(F)(F)F	PADEL_KR1559
PADEL_KR1560	[!#1]C1(F)OC([!#1])(F)C([!#1])(F)C1([!#1])F	PADEL_KR1560
PADEL_KR1561	[!#1]C1(F)OC(F)(F)C(F)(F)C1(F)F	PADEL_KR1561
PADEL_KR1562	[!#1]C1(O[CH]2[CH]=[CH]1)[CH]3[CH]2C(=O)N(C3=O)c4[cH][cH][cH][cH][cH]4	PADEL_KR1562
PADEL_KR1563	[!#1]C1(Oc2[cH][cH][cH][cH]c2O1)C(Cl)(Cl)Cl	PADEL_KR1563
PADEL_KR1564	[!#1]c1[cH][cH][cH][cH][cH]1	PADEL_KR1564
PADEL_KR1565	[!#1]c1[cH][cH][cH][cH][n+]1[!#1]	PADEL_KR1565
PADEL_KR1566	[!#1]c1[cH][cH][cH][cH]c1[!#1]	PADEL_KR1566
PADEL_KR1567	[!#1]c1[cH][cH][cH][cH]c1[CH2][CH3]	PADEL_KR1567
PADEL_KR1568	[!#1]c1[cH][cH][cH][cH]c1[CH3]	PADEL_KR1568
PADEL_KR1569	[!#1]c1[cH][cH][cH][cH]c1[N+](=O)[O-]	PADEL_KR1569
PADEL_KR1570	[!#1]c1[cH][cH][cH][cH]c1[NH2]	PADEL_KR1570
PADEL_KR1571	[!#1]c1[cH][cH][cH][cH]c1[OH]	PADEL_KR1571
PADEL_KR1572	[!#1]c1[cH][cH][cH][cH]c1Br	PADEL_KR1572
PADEL_KR1573	[!#1]c1[cH][cH][cH][cH]c1C#N	PADEL_KR1573
PADEL_KR1574	[!#1]c1[cH][cH][cH][cH]c1C(=O)[CH3]	PADEL_KR1574
PADEL_KR1575	[!#1]c1[cH][cH][cH][cH]c1C(=O)[OH]	PADEL_KR1575
PADEL_KR1576	[!#1]c1[cH][cH][cH][cH]c1C(=O)c2[cH]c([!#1])nnc2[!#1]	PADEL_KR1576
PADEL_KR1577	[!#1]c1[cH][cH][cH][cH]c1C(F)(F)F	PADEL_KR1577
PADEL_KR1578	[!#1]c1[cH][cH][cH][cH]c1c2[cH][cH][cH][cH][cH]2	PADEL_KR1578
PADEL_KR1579	[!#1]c1[cH][cH][cH][cH]c1c2[cH][cH][cH][cH]c2[!#1]	PADEL_KR1579
PADEL_KR1580	[!#1]c1[cH][cH][cH][cH]c1c2n[nH]c(=S)[nH]c2=O	PADEL_KR1580
PADEL_KR1581	[!#1]c1[cH][cH][cH][cH]c1c2nc3[cH][cH][cH][cH]c3c(=O)[nH]2	PADEL_KR1581
PADEL_KR1582	[!#1]c1[cH][cH][cH][cH]c1c2nc3[cH][cH][cH][cH]c3s2	PADEL_KR1582
PADEL_KR1583	[!#1]c1[cH][cH][cH][cH]c1Cl	PADEL_KR1583
PADEL_KR1584	[!#1]c1[cH][cH][cH][cH]c1F	PADEL_KR1584
PADEL_KR1585	[!#1]c1[cH][cH][cH][cH]c1I	PADEL_KR1585
PADEL_KR1586	[!#1]c1[cH][cH][cH][cH]c1N2C(=O)[CH]=[CH]C2=O	PADEL_KR1586
PADEL_KR1587	[!#1]c1[cH][cH][cH][cH]c1N2C(=O)[CH]3[CH]([CH]([CH]=[CH][CH]3c4[cH][cH][cH][cH][cH]4)c5[cH][cH][cH][cH][cH]5)C2=O	PADEL_KR1587
PADEL_KR1588	[!#1]c1[cH][cH][cH][cH]c1O[CH3]	PADEL_KR1588
PADEL_KR1589	[!#1]c1[cH][cH][cH][cH]n1	PADEL_KR1589
PADEL_KR1590	[!#1]c1[cH][cH][cH][nH]1	PADEL_KR1590
PADEL_KR1591	[!#1]c1[cH][cH][cH]c([!#1])[cH]1	PADEL_KR1591
PADEL_KR1592	[!#1]c1[cH][cH][cH]c([!#1])c1[!#1]	PADEL_KR1592
PADEL_KR1593	[!#1]c1[cH][cH][cH]c([!#1])c1n2nnnc2C3([!#1])[CH2][CH2][CH2][CH2][CH2]3	PADEL_KR1593
PADEL_KR1594	[!#1]c1[cH][cH][cH]c([!#1])n1	PADEL_KR1594
PADEL_KR1595	[!#1]c1[cH][cH][cH]c([CH]=[CH]C(=O)[OH])[cH]1	PADEL_KR1595
PADEL_KR1596	[!#1]c1[cH][cH][cH]c([cH]1)[CH]2[CH2]C(=N[CH2][CH2]S2)c3c([!#1])[cH]c([!#1])oc3=O	PADEL_KR1596
PADEL_KR1597	[!#1]c1[cH][cH][cH]c([cH]1)[N+](=O)[O-]	PADEL_KR1597
PADEL_KR1598	[!#1]c1[cH][cH][cH]c([cH]1)C(=O)[CH3]	PADEL_KR1598
PADEL_KR1599	[!#1]c1[cH][cH][cH]c([cH]1)C(=O)[OH]	PADEL_KR1599
PADEL_KR1600	[!#1]c1[cH][cH][cH]c([cH]1)C(F)(F)F	PADEL_KR1600
PADEL_KR1601	[!#1]c1[cH][cH][cH]c([cH]1)c2[cH]nc3[cH][cH][cH][cH]c3n2	PADEL_KR1601
PADEL_KR1602	[!#1]c1[cH][cH][cH]c([cH]1)c2nc3[cH][cH][cH][cH]c3o2	PADEL_KR1602
PADEL_KR1603	[!#1]c1[cH][cH][cH]c([cH]1)c2nc3[cH]c([!#1])[cH][cH]c3o2	PADEL_KR1603
PADEL_KR1604	[!#1]c1[cH][cH][cH]c([cH]1)N2[CH2][CH2][CH2]C2=O	PADEL_KR1604
PADEL_KR1605	[!#1]c1[cH][cH][cH]c([cH]1)N2C(=O)c3[cH][cH][cH][cH]c3C2=O	PADEL_KR1605
PADEL_KR1606	[!#1]c1[cH][cH][cH]c([cH]1)S(=O)(=O)[!#1]	PADEL_KR1606
PADEL_KR1607	[!#1]c1[cH][cH][cH]c([CH2][CH3])[cH]1	PADEL_KR1607
PADEL_KR1608	[!#1]c1[cH][cH][cH]c([CH2][OH])[cH]1	PADEL_KR1608
PADEL_KR1609	[!#1]c1[cH][cH][cH]c([CH3])[cH]1	PADEL_KR1609
PADEL_KR1610	[!#1]c1[cH][cH][cH]c([CH3])c1[CH3]	PADEL_KR1610
PADEL_KR1611	[!#1]c1[cH][cH][cH]c([CH3])n1	PADEL_KR1611
PADEL_KR1612	[!#1]c1[cH][cH][cH]c([N+](=O)[O-])c1[!#1]	PADEL_KR1612
PADEL_KR1613	[!#1]c1[cH][cH][cH]c([NH2])[cH]1	PADEL_KR1613
PADEL_KR1614	[!#1]c1[cH][cH][cH]c([OH])[cH]1	PADEL_KR1614
PADEL_KR1615	[!#1]c1[cH][cH][cH]c(Br)[cH]1	PADEL_KR1615
PADEL_KR1616	[!#1]c1[cH][cH][cH]c(Cl)[cH]1	PADEL_KR1616
PADEL_KR1617	[!#1]c1[cH][cH][cH]c(Cl)c1[CH3]	PADEL_KR1617
PADEL_KR1618	[!#1]c1[cH][cH][cH]c(Cl)c1Cl	PADEL_KR1618
PADEL_KR1619	[!#1]c1[cH][cH][cH]c(F)[cH]1	PADEL_KR1619
PADEL_KR1620	[!#1]c1[cH][cH][cH]c(I)[cH]1	PADEL_KR1620
PADEL_KR1621	[!#1]c1[cH][cH][cH]c(O[CH3])[cH]1	PADEL_KR1621
PADEL_KR1622	[!#1]c1[cH][cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR1622
PADEL_KR1623	[!#1]c1[cH][cH][cH]c2[cH][cH][cH]c([!#1])c12	PADEL_KR1623
PADEL_KR1624	[!#1]c1[cH][cH][cH]c2[cH][cH][cH]nc12	PADEL_KR1624
PADEL_KR1625	[!#1]c1[cH][cH][cH]c2[CH2][CH2][CH2][CH2]c12	PADEL_KR1625
PADEL_KR1626	[!#1]c1[cH][cH][cH]c2c([!#1])[cH][cH][cH]c12	PADEL_KR1626
PADEL_KR1627	[!#1]c1[cH][cH][cH]c2c(=O)[nH][nH]c(=O)c12	PADEL_KR1627
PADEL_KR1628	[!#1]c1[cH][cH][cH]c2C(=O)c3[cH][cH][cH][cH]c3C(=O)c12	PADEL_KR1628
PADEL_KR1629	[!#1]c1[cH][cH][cH]c2C(=O)c3[cH][cH][cH]c([!#1])c3C(=O)c12	PADEL_KR1629
PADEL_KR1630	[!#1]c1[cH][cH][cH]c2c3[CH2][CH2][CH2][CH2]c3oc12	PADEL_KR1630
PADEL_KR1631	[!#1]c1[cH][cH][cH]c2n[cH][cH][cH]c12	PADEL_KR1631
PADEL_KR1632	[!#1]c1[cH][cH][cH]c2nsnc12	PADEL_KR1632
PADEL_KR1633	[!#1]c1[cH][cH][cH]n[cH]1	PADEL_KR1633
PADEL_KR1634	[!#1]c1[cH][cH][cH]nc1[!#1]	PADEL_KR1634
PADEL_KR1635	[!#1]c1[cH][cH][cH]nc1c2[cH]c([!#1])c([!#1])c([!#1])[cH]2	PADEL_KR1635
PADEL_KR1636	[!#1]c1[cH][cH][cH]nc1c2n[cH][cH][cH]c2[!#1]	PADEL_KR1636
PADEL_KR1637	[!#1]c1[cH][cH][cH]o1	PADEL_KR1637
PADEL_KR1638	[!#1]c1[cH][cH][cH]s1	PADEL_KR1638
PADEL_KR1639	[!#1]c1[cH][cH][n+]([!#1])[cH][cH]1	PADEL_KR1639
PADEL_KR1640	[!#1]c1[cH][cH][n+]([!#1])c2[cH][cH][cH][cH]c12	PADEL_KR1640
PADEL_KR1641	[!#1]c1[cH][cH][n+]([O-])[cH][cH]1	PADEL_KR1641
PADEL_KR1642	[!#1]c1[cH][cH]c([!#1])[cH][cH]1	PADEL_KR1642
PADEL_KR1643	[!#1]c1[cH][cH]c([!#1])[cH]c1S(=O)(=O)c2[cH]c([!#1])[cH][cH]c2[!#1]	PADEL_KR1643
PADEL_KR1644	[!#1]c1[cH][cH]c([!#1])[n+]([!#1])[cH]1	PADEL_KR1644
PADEL_KR1645	[!#1]c1[cH][cH]c([!#1])c([!#1])[cH]1	PADEL_KR1645
PADEL_KR1646	[!#1]c1[cH][cH]c([!#1])c([!#1])c1[!#1]	PADEL_KR1646
PADEL_KR1647	[!#1]c1[cH][cH]c([!#1])c([!#1])n1	PADEL_KR1647
PADEL_KR1648	[!#1]c1[cH][cH]c([!#1])c([cH]1)[N+](=O)[O-]	PADEL_KR1648
PADEL_KR1649	[!#1]c1[cH][cH]c([!#1])c([cH]1)C(=O)[OH]	PADEL_KR1649
PADEL_KR1650	[!#1]c1[cH][cH]c([!#1])c([cH]1)c2[cH][cH][cH][cH][cH]2	PADEL_KR1650
PADEL_KR1651	[!#1]c1[cH][cH]c([!#1])c([cH]1)c2nc3[cH][cH][cH][cH]c3s2	PADEL_KR1651
PADEL_KR1652	[!#1]c1[cH][cH]c([!#1])c([CH3])[cH]1	PADEL_KR1652
PADEL_KR1653	[!#1]c1[cH][cH]c([!#1])c([OH])[cH]1	PADEL_KR1653
PADEL_KR1654	[!#1]c1[cH][cH]c([!#1])c(Cl)[cH]1	PADEL_KR1654
PADEL_KR1655	[!#1]c1[cH][cH]c([!#1])c2[cH][cH][cH][cH]c12	PADEL_KR1655
PADEL_KR1656	[!#1]c1[cH][cH]c([!#1])c2c([!#1])[cH][cH][cH]c12	PADEL_KR1656
PADEL_KR1657	[!#1]c1[cH][cH]c([!#1])c2n[cH][cH][cH]c12	PADEL_KR1657
PADEL_KR1658	[!#1]c1[cH][cH]c([!#1])c2nonc12	PADEL_KR1658
PADEL_KR1659	[!#1]c1[cH][cH]c([!#1])n[cH]1	PADEL_KR1659
PADEL_KR1660	[!#1]c1[cH][cH]c([!#1])n1c2[cH][cH]c([!#1])[cH][cH]2	PADEL_KR1660
PADEL_KR1661	[!#1]c1[cH][cH]c([!#1])nn1	PADEL_KR1661
PADEL_KR1662	[!#1]c1[cH][cH]c([!#1])o1	PADEL_KR1662
PADEL_KR1663	[!#1]c1[cH][cH]c([!#1])s1	PADEL_KR1663
PADEL_KR1664	[!#1]c1[cH][cH]c([cH][cH]1)[CH]([CH3])[CH3]	PADEL_KR1664
PADEL_KR1665	[!#1]c1[cH][cH]c([cH][cH]1)[CH]2[CH]3[CH2][CH]4[CH2][CH]([CH2]3)[CH2][CH]2[CH2]4	PADEL_KR1665
PADEL_KR1666	[!#1]c1[cH][cH]c([cH][cH]1)[CH]2[CH2][CH2][CH2][CH2][CH2]2	PADEL_KR1666
PADEL_KR1667	[!#1]c1[cH][cH]c([cH][cH]1)[CH]2[NH]c3[cH][cH]c4n[cH][cH][cH]c4c3C5=C2C(=O)[CH2][CH2][CH2]5	PADEL_KR1667
PADEL_KR1668	[!#1]c1[cH][cH]c([cH][cH]1)[CH]2N([CH2][CH2]N2c3[cH][cH][cH][cH][cH]3)c4[cH][cH][cH][cH][cH]4	PADEL_KR1668
PADEL_KR1669	[!#1]c1[cH][cH]c([cH][cH]1)[CH]2N=NC(=[CH][CH]2c3[cH][cH][cH][cH][cH]3)[CH]4C(=O)c5[cH][cH][cH][cH]c5C4=O	PADEL_KR1669
PADEL_KR1670	[!#1]c1[cH][cH]c([cH][cH]1)[N+](=O)[O-]	PADEL_KR1670
PADEL_KR1671	[!#1]c1[cH][cH]c([cH][cH]1)[NH](=O)[OH]	PADEL_KR1671
PADEL_KR1672	[!#1]c1[cH][cH]c([cH][cH]1)C([!#1])([CH3])[CH3]	PADEL_KR1672
PADEL_KR1673	[!#1]c1[cH][cH]c([cH][cH]1)C([CH3])([CH3])[CH3]	PADEL_KR1673
PADEL_KR1674	[!#1]c1[cH][cH]c([cH][cH]1)C(=N[NH]c2[cH][cH]c([cH]c2[N+](=O)[O-])[N+](=O)[O-])[CH3]	PADEL_KR1674
PADEL_KR1675	[!#1]c1[cH][cH]c([cH][cH]1)C(=N[OH])[CH3]	PADEL_KR1675
PADEL_KR1676	[!#1]c1[cH][cH]c([cH][cH]1)C(=O)[CH3]	PADEL_KR1676
PADEL_KR1677	[!#1]c1[cH][cH]c([cH][cH]1)C(=O)[OH]	PADEL_KR1677
PADEL_KR1678	[!#1]c1[cH][cH]c([cH][cH]1)C(=O)C(=O)c2[cH][cH][cH][cH][cH]2	PADEL_KR1678
PADEL_KR1679	[!#1]c1[cH][cH]c([cH][cH]1)C2([!#1])C(=O)c3[cH][cH][cH][cH]c3C2=O	PADEL_KR1679
PADEL_KR1680	[!#1]c1[cH][cH]c([cH][cH]1)C2([CH2][CH]3[CH2][CH]4[CH2][CH]([CH2]3)[CH2]2)[CH2]4	PADEL_KR1680
PADEL_KR1681	[!#1]c1[cH][cH]c([cH][cH]1)C2([NH]C(=O)c3[cH][cH][cH][cH]c32)c4[cH][cH]c([!#1])[cH][cH]4	PADEL_KR1681
PADEL_KR1682	[!#1]c1[cH][cH]c([cH][cH]1)C2(c3[cH][cH][cH][cH]c3-c4[cH][cH][cH][cH]c42)c5[cH][cH]c([!#1])[cH][cH]5	PADEL_KR1682
PADEL_KR1683	[!#1]c1[cH][cH]c([cH][cH]1)C2(OC(=O)c3[cH][cH][cH][cH]c32)c4[cH][cH]c([!#1])[cH][cH]4	PADEL_KR1683
PADEL_KR1684	[!#1]c1[cH][cH]c([cH][cH]1)c2[cH][cH][cH][cH][cH]2	PADEL_KR1684
PADEL_KR1685	[!#1]c1[cH][cH]c([cH][cH]1)c2[cH][cH][cH]c(n2)c3[cH][cH]c([!#1])[cH][cH]3	PADEL_KR1685
PADEL_KR1686	[!#1]c1[cH][cH]c([cH][cH]1)c2[cH][cH]c([!#1])[cH][cH]2	PADEL_KR1686
PADEL_KR1687	[!#1]c1[cH][cH]c([cH][cH]1)c2[cH][cH]c([cH][cH]2)S(=O)(=O)[!#1]	PADEL_KR1687
PADEL_KR1688	[!#1]c1[cH][cH]c([cH][cH]1)c2[cH]c(nc(n2)c3[cH][cH][cH][cH][cH]3)c4[cH][cH]c([!#1])[cH][cH]4	PADEL_KR1688
PADEL_KR1689	[!#1]c1[cH][cH]c([cH][cH]1)c2[cH]nc(n[cH]2)c3[cH][cH]c([!#1])[cH][cH]3	PADEL_KR1689
PADEL_KR1690	[!#1]c1[cH][cH]c([cH][cH]1)c2[cH]nc3[cH][cH][cH][cH]c3n2	PADEL_KR1690
PADEL_KR1691	[!#1]c1[cH][cH]c([cH][cH]1)c2n[cH][cH][cH]c2[!#1]	PADEL_KR1691
PADEL_KR1692	[!#1]c1[cH][cH]c([cH][cH]1)c2nc([!#1])[cH][cH]c2[!#1]	PADEL_KR1692
PADEL_KR1693	[!#1]c1[cH][cH]c([cH][cH]1)c2nc([!#1])[cH]c([!#1])c2[!#1]	PADEL_KR1693
PADEL_KR1694	[!#1]c1[cH][cH]c([cH][cH]1)c2nc(c3[cH][cH]c([!#1])[cH][cH]3)c4[cH][cH][cH][cH]c4n2	PADEL_KR1694
PADEL_KR1695	[!#1]c1[cH][cH]c([cH][cH]1)c2nc3[cH][cH][cH][cH]c3[nH]2	PADEL_KR1695
PADEL_KR1696	[!#1]c1[cH][cH]c([cH][cH]1)c2nc3[cH][cH][cH][cH]c3nc2c4[cH][cH][cH][cH][cH]4	PADEL_KR1696
PADEL_KR1697	[!#1]c1[cH][cH]c([cH][cH]1)c2nc3[cH][cH][cH][cH]c3nc2c4[cH][cH]c([!#1])[cH][cH]4	PADEL_KR1697
PADEL_KR1698	[!#1]c1[cH][cH]c([cH][cH]1)c2nc3[cH][cH][cH][cH]c3o2	PADEL_KR1698
PADEL_KR1699	[!#1]c1[cH][cH]c([cH][cH]1)c2nc3[cH][cH][cH][cH]c3s2	PADEL_KR1699
PADEL_KR1700	[!#1]c1[cH][cH]c([cH][cH]1)c2nc3[cH][cH]c([!#1])[cH]c3[nH]2	PADEL_KR1700
PADEL_KR1701	[!#1]c1[cH][cH]c([cH][cH]1)c2nc3[cH][cH]c([!#1])[cH]c3o2	PADEL_KR1701
PADEL_KR1702	[!#1]c1[cH][cH]c([cH][cH]1)c2nc3[cH][cH]c([!#1])[cH]c3s2	PADEL_KR1702
PADEL_KR1703	[!#1]c1[cH][cH]c([cH][cH]1)c2nc3[cH][cH]c([cH]c3[nH]2)c4nc5[cH][cH]c([!#1])[cH]c5[nH]4	PADEL_KR1703
PADEL_KR1704	[!#1]c1[cH][cH]c([cH][cH]1)c2nc3[cH]c([!#1])[cH][cH]c3[nH]2	PADEL_KR1704
PADEL_KR1705	[!#1]c1[cH][cH]c([cH][cH]1)c2nc3[cH]c([!#1])[cH][cH]c3o2	PADEL_KR1705
PADEL_KR1706	[!#1]c1[cH][cH]c([cH][cH]1)c2sc(c(c2c3[cH][cH][cH][cH][cH]3)c4[cH][cH][cH][cH][cH]4)c5[cH][cH]c([!#1])[cH][cH]5	PADEL_KR1706
PADEL_KR1707	[!#1]c1[cH][cH]c([cH][cH]1)N([CH3])[CH3]	PADEL_KR1707
PADEL_KR1708	[!#1]c1[cH][cH]c([cH][cH]1)N2[CH2][CH2][CH2]C2=O	PADEL_KR1708
PADEL_KR1709	[!#1]c1[cH][cH]c([cH][cH]1)N2[CH2][CH2]C(=N2)c3[cH][cH]c([!#1])[cH][cH]3	PADEL_KR1709
PADEL_KR1710	[!#1]c1[cH][cH]c([cH][cH]1)N2[CH2][CH2]O[CH2][CH2]2	PADEL_KR1710
PADEL_KR1711	[!#1]c1[cH][cH]c([cH][cH]1)n2c([CH3])[cH][cH]c2[CH3]	PADEL_KR1711
PADEL_KR1712	[!#1]c1[cH][cH]c([cH][cH]1)N2C(=O)[CH]=[CH]C2=O	PADEL_KR1712
PADEL_KR1713	[!#1]c1[cH][cH]c([cH][cH]1)N2C(=O)[CH]3[CH]4[CH2][CH]([CH]=[CH]4)[CH]3C2=O	PADEL_KR1713
PADEL_KR1714	[!#1]c1[cH][cH]c([cH][cH]1)N2C(=O)[CH2][CH](N3[CH2][CH2][CH2][CH2][CH2]3)C2=O	PADEL_KR1714
PADEL_KR1715	[!#1]c1[cH][cH]c([cH][cH]1)N2C(=O)[CH2][CH](N3[CH2][CH2][CH2][CH2]3)C2=O	PADEL_KR1715
PADEL_KR1716	[!#1]c1[cH][cH]c([cH][cH]1)N2C(=O)[CH2][CH](N3[CH2][CH2]N([CH2][CH2]3)[CH]4[CH2]C(=O)N(C4=O)c5[cH][cH]c([!#1])[cH][cH]5)C2=O	PADEL_KR1716
PADEL_KR1717	[!#1]c1[cH][cH]c([cH][cH]1)N2C(=O)[CH2][CH](N3[CH2][CH2]N([CH2][CH2]3)c4n[cH][cH][cH]n4)C2=O	PADEL_KR1717
PADEL_KR1718	[!#1]c1[cH][cH]c([cH][cH]1)N2C(=O)[CH2][CH](N3[CH2][CH2]O[CH2][CH2]3)C2=O	PADEL_KR1718
PADEL_KR1719	[!#1]c1[cH][cH]c([cH][cH]1)N2C(=O)c3[cH][cH][cH][cH]c3C2=O	PADEL_KR1719
PADEL_KR1720	[!#1]c1[cH][cH]c([cH][cH]1)N2C(=O)c3[cH][cH][cH]c([!#1])c3C2=O	PADEL_KR1720
PADEL_KR1721	[!#1]c1[cH][cH]c([cH][cH]1)N2C(=O)c3[cH][cH]c([!#1])[cH]c3C2=O	PADEL_KR1721
PADEL_KR1722	[!#1]c1[cH][cH]c([cH][cH]1)N2C(=O)c3[cH][cH]c([cH]c3C2=O)C(=O)[OH]	PADEL_KR1722
PADEL_KR1723	[!#1]c1[cH][cH]c([cH][cH]1)n2c(=O)c3[cH]c4c(=O)n(c5[cH][cH]c([!#1])[cH][cH]5)c(=O)c4[cH]c3c2=O	PADEL_KR1723
PADEL_KR1724	[!#1]c1[cH][cH]c([cH][cH]1)S(=O)(=O)[!#1]	PADEL_KR1724
PADEL_KR1725	[!#1]c1[cH][cH]c([cH][cH]1)S(=O)(=O)[NH2]	PADEL_KR1725
PADEL_KR1726	[!#1]c1[cH][cH]c([cH][cH]1)S(=O)(=O)[OH]	PADEL_KR1726
PADEL_KR1727	[!#1]c1[cH][cH]c([cH][cH]1)S(=O)(=O)c2[cH][cH]c([!#1])[cH][cH]2	PADEL_KR1727
PADEL_KR1728	[!#1]c1[cH][cH]c([CH]=[CH]c2[cH][cH][cH][cH][cH]2)[cH][cH]1	PADEL_KR1728
PADEL_KR1729	[!#1]c1[cH][cH]c([CH]=[CH]c2[cH][cH]c([!#1])[cH]c2S(=O)(=O)[OH])c([cH]1)S(=O)(=O)[OH]	PADEL_KR1729
PADEL_KR1730	[!#1]c1[cH][cH]c([CH]=N[NH]c2[cH][cH]c([cH][cH]2)S(=O)(=O)[OH])[cH][cH]1	PADEL_KR1730
PADEL_KR1731	[!#1]c1[cH][cH]c([CH]=N[NH]c2nc([!#1])nc([!#1])n2)o1	PADEL_KR1731
PADEL_KR1732	[!#1]c1[cH][cH]c([CH]=O)[cH][cH]1	PADEL_KR1732
PADEL_KR1733	[!#1]c1[cH][cH]c([cH]c1[!#1])[N+](=O)[O-]	PADEL_KR1733
PADEL_KR1734	[!#1]c1[cH][cH]c([cH]c1[!#1])C(=O)[OH]	PADEL_KR1734
PADEL_KR1735	[!#1]c1[cH][cH]c([cH]c1[!#1])c2[cH][cH][cH][cH][cH]2	PADEL_KR1735
PADEL_KR1736	[!#1]c1[cH][cH]c([cH]c1[!#1])c2[cH][cH]c([!#1])c([!#1])[cH]2	PADEL_KR1736
PADEL_KR1737	[!#1]c1[cH][cH]c([cH]c1[!#1])c2n[cH][cH][cH]c2[!#1]	PADEL_KR1737
PADEL_KR1738	[!#1]c1[cH][cH]c([cH]c1[CH3])[N+](=O)[O-]	PADEL_KR1738
PADEL_KR1739	[!#1]c1[cH][cH]c([cH]c1[CH3])C([CH3])([CH3])[CH3]	PADEL_KR1739
PADEL_KR1740	[!#1]c1[cH][cH]c([cH]c1[CH3])c2[cH][cH]c([!#1])c([CH3])[cH]2	PADEL_KR1740
PADEL_KR1741	[!#1]c1[cH][cH]c([cH]c1[N+](=O)[O-])[N+](=O)[O-]	PADEL_KR1741
PADEL_KR1742	[!#1]c1[cH][cH]c([cH]c1[N+](=O)[O-])C(F)(F)F	PADEL_KR1742
PADEL_KR1743	[!#1]c1[cH][cH]c([cH]c1[N+](=O)[O-])S(=O)(=O)[!#1]	PADEL_KR1743
PADEL_KR1744	[!#1]c1[cH][cH]c([cH]c1Br)[N+](=O)[O-]	PADEL_KR1744
PADEL_KR1745	[!#1]c1[cH][cH]c([cH]c1C(=O)[OH])[N+](=O)[O-]	PADEL_KR1745
PADEL_KR1746	[!#1]c1[cH][cH]c([cH]c1Cl)[N+](=O)[O-]	PADEL_KR1746
PADEL_KR1747	[!#1]c1[cH][cH]c([CH2][CH2][CH3])[cH][cH]1	PADEL_KR1747
PADEL_KR1748	[!#1]c1[cH][cH]c([CH2][CH3])[cH][cH]1	PADEL_KR1748
PADEL_KR1749	[!#1]c1[cH][cH]c([CH2]c2[cH][cH]c([!#1])[cH][cH]2)[cH][cH]1	PADEL_KR1749
PADEL_KR1750	[!#1]c1[cH][cH]c([CH3])[cH][cH]1	PADEL_KR1750
PADEL_KR1751	[!#1]c1[cH][cH]c([CH3])[cH]c1[CH3]	PADEL_KR1751
PADEL_KR1752	[!#1]c1[cH][cH]c([CH3])[cH]c1[N+](=O)[O-]	PADEL_KR1752
PADEL_KR1753	[!#1]c1[cH][cH]c([CH3])[cH]c1[OH]	PADEL_KR1753
PADEL_KR1754	[!#1]c1[cH][cH]c([CH3])[cH]c1Br	PADEL_KR1754
PADEL_KR1755	[!#1]c1[cH][cH]c([CH3])[cH]n1	PADEL_KR1755
PADEL_KR1756	[!#1]c1[cH][cH]c([CH3])c([!#1])[cH]1	PADEL_KR1756
PADEL_KR1757	[!#1]c1[cH][cH]c([CH3])c([cH]1)[N+](=O)[O-]	PADEL_KR1757
PADEL_KR1758	[!#1]c1[cH][cH]c([CH3])c([CH3])[cH]1	PADEL_KR1758
PADEL_KR1759	[!#1]c1[cH][cH]c([CH3])c([NH2])[cH]1	PADEL_KR1759
PADEL_KR1760	[!#1]c1[cH][cH]c([CH3])c(Br)[cH]1	PADEL_KR1760
PADEL_KR1761	[!#1]c1[cH][cH]c([CH3])c(Cl)[cH]1	PADEL_KR1761
PADEL_KR1762	[!#1]c1[cH][cH]c([CH3])c(I)[cH]1	PADEL_KR1762
PADEL_KR1763	[!#1]c1[cH][cH]c([CH3])n[cH]1	PADEL_KR1763
PADEL_KR1764	[!#1]c1[cH][cH]c([CH3])o1	PADEL_KR1764
PADEL_KR1765	[!#1]c1[cH][cH]c([N+](=O)[O-])c([CH3])[cH]1	PADEL_KR1765
PADEL_KR1766	[!#1]c1[cH][cH]c([N+](=O)[O-])c2nonc12	PADEL_KR1766
PADEL_KR1767	[!#1]c1[cH][cH]c([NH2])[cH][cH]1	PADEL_KR1767
PADEL_KR1768	[!#1]c1[cH][cH]c([NH2])c([cH]1)[N+](=O)[O-]	PADEL_KR1768
PADEL_KR1769	[!#1]c1[cH][cH]c([OH])[cH][cH]1	PADEL_KR1769
PADEL_KR1770	[!#1]c1[cH][cH]c([OH])[cH]c1[OH]	PADEL_KR1770
PADEL_KR1771	[!#1]c1[cH][cH]c([OH])c([!#1])[cH]1	PADEL_KR1771
PADEL_KR1772	[!#1]c1[cH][cH]c([OH])c([cH]1)C(=O)[OH]	PADEL_KR1772
PADEL_KR1773	[!#1]c1[cH][cH]c([OH])c([OH])[cH]1	PADEL_KR1773
PADEL_KR1774	[!#1]c1[cH][cH]c(=S)[nH]n1	PADEL_KR1774
PADEL_KR1775	[!#1]c1[cH][cH]c(Br)[cH][cH]1	PADEL_KR1775
PADEL_KR1776	[!#1]c1[cH][cH]c(Br)[cH]c1[!#1]	PADEL_KR1776
PADEL_KR1777	[!#1]c1[cH][cH]c(Br)[cH]c1Br	PADEL_KR1777
PADEL_KR1778	[!#1]c1[cH][cH]c(Br)[cH]n1	PADEL_KR1778
PADEL_KR1779	[!#1]c1[cH][cH]c(Br)c([!#1])[cH]1	PADEL_KR1779
PADEL_KR1780	[!#1]c1[cH][cH]c(Br)c([cH]1)[N+](=O)[O-]	PADEL_KR1780
PADEL_KR1781	[!#1]c1[cH][cH]c(Br)c(Cl)[cH]1	PADEL_KR1781
PADEL_KR1782	[!#1]c1[cH][cH]c(Br)c2[cH][cH][cH][cH]c12	PADEL_KR1782
PADEL_KR1783	[!#1]c1[cH][cH]c(Br)o1	PADEL_KR1783
PADEL_KR1784	[!#1]c1[cH][cH]c(C(=O)[OH])c([!#1])[cH]1	PADEL_KR1784
PADEL_KR1785	[!#1]c1[cH][cH]c(C(=O)[OH])c([cH]1)C(=O)[OH]	PADEL_KR1785
PADEL_KR1786	[!#1]c1[cH][cH]c(Cl)[cH][cH]1	PADEL_KR1786
PADEL_KR1787	[!#1]c1[cH][cH]c(Cl)[cH]c1[!#1]	PADEL_KR1787
PADEL_KR1788	[!#1]c1[cH][cH]c(Cl)[cH]c1[CH3]	PADEL_KR1788
PADEL_KR1789	[!#1]c1[cH][cH]c(Cl)[cH]c1[N+](=O)[O-]	PADEL_KR1789
PADEL_KR1790	[!#1]c1[cH][cH]c(Cl)[cH]c1Br	PADEL_KR1790
PADEL_KR1791	[!#1]c1[cH][cH]c(Cl)[cH]c1Cl	PADEL_KR1791
PADEL_KR1792	[!#1]c1[cH][cH]c(Cl)[cH]n1	PADEL_KR1792
PADEL_KR1793	[!#1]c1[cH][cH]c(Cl)c([!#1])[cH]1	PADEL_KR1793
PADEL_KR1794	[!#1]c1[cH][cH]c(Cl)c([cH]1)[N+](=O)[O-]	PADEL_KR1794
PADEL_KR1795	[!#1]c1[cH][cH]c(Cl)c([CH3])[cH]1	PADEL_KR1795
PADEL_KR1796	[!#1]c1[cH][cH]c(Cl)c(Cl)[cH]1	PADEL_KR1796
PADEL_KR1797	[!#1]c1[cH][cH]c(Cl)c2[cH][cH][cH][cH]c12	PADEL_KR1797
PADEL_KR1798	[!#1]c1[cH][cH]c(F)[cH][cH]1	PADEL_KR1798
PADEL_KR1799	[!#1]c1[cH][cH]c(F)[cH]c1F	PADEL_KR1799
PADEL_KR1800	[!#1]c1[cH][cH]c(F)c(Cl)[cH]1	PADEL_KR1800
PADEL_KR1801	[!#1]c1[cH][cH]c(F)c(F)[cH]1	PADEL_KR1801
PADEL_KR1802	[!#1]c1[cH][cH]c(I)[cH][cH]1	PADEL_KR1802
PADEL_KR1803	[!#1]c1[cH][cH]c(N=[CH]c2[cH][cH][cH][cH]c2[OH])[cH][cH]1	PADEL_KR1803
PADEL_KR1804	[!#1]c1[cH][cH]c(N=[CH]c2[cH][cH]c([cH][cH]2)[N+](=O)[O-])[cH][cH]1	PADEL_KR1804
PADEL_KR1805	[!#1]c1[cH][cH]c(N=[CH]c2[cH]c([cH][cH]c2[OH])[N+](=O)[O-])[cH][cH]1	PADEL_KR1805
PADEL_KR1806	[!#1]c1[cH][cH]c(N=[CH]c2c([OH])[cH][cH]c3[cH][cH][cH][cH]c23)[cH][cH]1	PADEL_KR1806
PADEL_KR1807	[!#1]c1[cH][cH]c(N=[N+]=[N-])[cH][cH]1	PADEL_KR1807
PADEL_KR1808	[!#1]c1[cH][cH]c(N=Nc2[cH][cH][cH][cH][cH]2)[cH][cH]1	PADEL_KR1808
PADEL_KR1809	[!#1]c1[cH][cH]c(N=Nc2[cH][cH][cH][cH]c2[CH3])[cH]c1[CH3]	PADEL_KR1809
PADEL_KR1810	[!#1]c1[cH][cH]c(N2[CH2][CH2][CH2]C2=O)c([!#1])[cH]1	PADEL_KR1810
PADEL_KR1811	[!#1]c1[cH][cH]c(O[CH3])[cH][cH]1	PADEL_KR1811
PADEL_KR1812	[!#1]c1[cH][cH]c(O[CH3])[cH]c1[N+](=O)[O-]	PADEL_KR1812
PADEL_KR1813	[!#1]c1[cH][cH]c(O[CH3])[cH]c1Br	PADEL_KR1813
PADEL_KR1814	[!#1]c1[cH][cH]c(O[CH3])[cH]c1O[CH3]	PADEL_KR1814
PADEL_KR1815	[!#1]c1[cH][cH]c(O[CH3])c(Cl)[cH]1	PADEL_KR1815
PADEL_KR1816	[!#1]c1[cH][cH]c(O[CH3])c(O[CH3])[cH]1	PADEL_KR1816
PADEL_KR1817	[!#1]c1[cH][cH]c(O[CH3])nn1	PADEL_KR1817
PADEL_KR1818	[!#1]c1[cH][cH]c(o1)[CH]2[CH2][CH]2[CH]3[CH2][CH2]3	PADEL_KR1818
PADEL_KR1819	[!#1]c1[cH][cH]c(o1)c2[cH][cH][cH]c([!#1])[cH]2	PADEL_KR1819
PADEL_KR1820	[!#1]c1[cH][cH]c(o1)c2[cH][cH]c([!#1])[cH][cH]2	PADEL_KR1820
PADEL_KR1821	[!#1]c1[cH][cH]c(S[CH2][CH2]c2[cH][cH]n[cH][cH]2)[cH][cH]1	PADEL_KR1821
PADEL_KR1822	[!#1]c1[cH][cH]c(S[CH3])[cH][cH]1	PADEL_KR1822
PADEL_KR1823	[!#1]c1[cH][cH]c(s1)C(=O)[OH]	PADEL_KR1823
PADEL_KR1824	[!#1]c1[cH][cH]c2[cH][cH][cH][cH]c2[cH]1	PADEL_KR1824
PADEL_KR1825	[!#1]c1[cH][cH]c2[cH][cH][cH][cH]c2[n+]1[!#1]	PADEL_KR1825
PADEL_KR1826	[!#1]c1[cH][cH]c2[cH][cH][cH][cH]c2c1[!#1]	PADEL_KR1826
PADEL_KR1827	[!#1]c1[cH][cH]c2[cH][cH][cH][cH]c2c1Br	PADEL_KR1827
PADEL_KR1828	[!#1]c1[cH][cH]c2[cH][cH][cH][cH]c2n1	PADEL_KR1828
PADEL_KR1829	[!#1]c1[cH][cH]c2[cH][cH][cH]c([!#1])c2n1	PADEL_KR1829
PADEL_KR1830	[!#1]c1[cH][cH]c2[cH][cH][cH]c([OH])c2n1	PADEL_KR1830
PADEL_KR1831	[!#1]c1[cH][cH]c2[cH][cH]c([!#1])[cH]c2[cH]1	PADEL_KR1831
PADEL_KR1832	[!#1]c1[cH][cH]c2[CH]3c4[cH][cH][cH][cH]c4[CH](c5[cH][cH][cH][cH]c35)c2[cH]1	PADEL_KR1832
PADEL_KR1833	[!#1]c1[cH][cH]c2[CH]3c4[cH][cH][cH][cH]c4[CH](c5[cH][cH]c([!#1])[cH]c35)c2[cH]1	PADEL_KR1833
PADEL_KR1834	[!#1]c1[cH][cH]c2[cH]c([!#1])[cH][cH]c2[cH]1	PADEL_KR1834
PADEL_KR1835	[!#1]c1[cH][cH]c2[cH]c([!#1])c(=O)oc2[cH]1	PADEL_KR1835
PADEL_KR1836	[!#1]c1[cH][cH]c2[cH]c([OH])[cH][cH]c2[cH]1	PADEL_KR1836
PADEL_KR1837	[!#1]c1[cH][cH]c2[CH2][CH2]c3[cH][cH][cH][cH]c3[NH]c2[cH]1	PADEL_KR1837
PADEL_KR1838	[!#1]c1[cH][cH]c2[CH2][CH2]c3[cH][cH][cH]c1c32	PADEL_KR1838
PADEL_KR1839	[!#1]c1[cH][cH]c2[CH2]OC(=O)c2[cH]1	PADEL_KR1839
PADEL_KR1840	[!#1]c1[cH][cH]c2[n+]([!#1])[cH][cH][cH]c2[cH]1	PADEL_KR1840
PADEL_KR1841	[!#1]c1[cH][cH]c2[n+]([!#1])c([!#1])[cH][cH]c2[cH]1	PADEL_KR1841
PADEL_KR1842	[!#1]c1[cH][cH]c2[nH]c(=O)[nH]c2[cH]1	PADEL_KR1842
PADEL_KR1843	[!#1]c1[cH][cH]c2[NH]C(=O)C(=O)c2[cH]1	PADEL_KR1843
PADEL_KR1844	[!#1]c1[cH][cH]c2[nH]c(=O)oc2[cH]1	PADEL_KR1844
PADEL_KR1845	[!#1]c1[cH][cH]c2[nH]c3C(=O)[CH2][CH2][CH2]c3c2[cH]1	PADEL_KR1845
PADEL_KR1846	[!#1]c1[cH][cH]c2[nH]c3C(=O)[NH][CH2][CH2]c3c2[cH]1	PADEL_KR1846
PADEL_KR1847	[!#1]c1[cH][cH]c2c([!#1])[cH]c(=O)oc2[cH]1	PADEL_KR1847
PADEL_KR1848	[!#1]c1[cH][cH]c2c([!#1])[n+]([!#1])[cH][cH]n12	PADEL_KR1848
PADEL_KR1849	[!#1]c1[cH][cH]c2c([!#1])c([!#1])[cH][cH]c2[cH]1	PADEL_KR1849
PADEL_KR1850	[!#1]c1[cH][cH]c2c([!#1])nc([!#1])nc2[cH]1	PADEL_KR1850
PADEL_KR1851	[!#1]c1[cH][cH]c2c([cH]1)-c3[cH]c([!#1])[cH][cH]c3S2(=O)=O	PADEL_KR1851
PADEL_KR1852	[!#1]c1[cH][cH]c2c([cH]1)nc3c4[cH][cH]c([!#1])c5[cH][cH][cH]c(c(=O)n23)c54	PADEL_KR1852
PADEL_KR1853	[!#1]c1[cH][cH]c2c([cH]1)oc3[cH][cH][cH][cH]c32	PADEL_KR1853
PADEL_KR1854	[!#1]c1[cH][cH]c-2c([CH2]c3[cH][cH][cH][cH]c32)[cH]1	PADEL_KR1854
PADEL_KR1855	[!#1]c1[cH][cH]c-2c([CH2]c3[cH]c([!#1])[cH][cH]c32)[cH]1	PADEL_KR1855
PADEL_KR1856	[!#1]c1[cH][cH]c2c([CH3])[cH]c(=O)oc2[cH]1	PADEL_KR1856
PADEL_KR1857	[!#1]c1[cH][cH]c2c(=O)c([!#1])[cH]oc2[cH]1	PADEL_KR1857
PADEL_KR1858	[!#1]c1[cH][cH]c2c(=O)c([!#1])c([!#1])oc2[cH]1	PADEL_KR1858
PADEL_KR1859	[!#1]c1[cH][cH]c2c(=O)c([!#1])c([CH3])oc2[cH]1	PADEL_KR1859
PADEL_KR1860	[!#1]c1[cH][cH]c2c(=O)c([cH]oc2[cH]1)c3[cH][cH]c4O[CH2][CH2]Oc4[cH]3	PADEL_KR1860
PADEL_KR1861	[!#1]c1[cH][cH]c2C(=O)c3[cH][cH][cH][cH]c3C(=O)c2[cH]1	PADEL_KR1861
PADEL_KR1862	[!#1]c1[cH][cH]c2C(=O)c3[cH][cH][cH][cH]c3-c2[cH]1	PADEL_KR1862
PADEL_KR1863	[!#1]c1[cH][cH]c2C(=O)N(C(=O)c2[cH]1)c3[cH][cH][cH][cH]c3[!#1]	PADEL_KR1863
PADEL_KR1864	[!#1]c1[cH][cH]c2C(=O)N(C(=O)c2[cH]1)c3[cH][cH][cH]c([!#1])[cH]3	PADEL_KR1864
PADEL_KR1865	[!#1]c1[cH][cH]c2C(=O)N(C(=O)c2[cH]1)c3[cH][cH][cH]c(n3)N4C(=O)c5[cH][cH]c([!#1])[cH]c5C4=O	PADEL_KR1865
PADEL_KR1866	[!#1]c1[cH][cH]c2C(=O)N(C(=O)c2[cH]1)c3[cH][cH][cH]c4[cH][cH][cH][cH]c34	PADEL_KR1866
PADEL_KR1867	[!#1]c1[cH][cH]c2C(=O)OC(=O)c2[cH]1	PADEL_KR1867
PADEL_KR1868	[!#1]c1[cH][cH]c2-c3[cH][cH]c([!#1])[cH]c3S(=O)(=O)c2[cH]1	PADEL_KR1868
PADEL_KR1869	[!#1]c1[cH][cH]c2n([!#1])c([CH3])c([CH3])c2[cH]1	PADEL_KR1869
PADEL_KR1870	[!#1]c1[cH][cH]c2n([!#1])c(=O)oc2[cH]1	PADEL_KR1870
PADEL_KR1871	[!#1]c1[cH][cH]c2n([!#1])c3[cH][cH][cH][cH]c3c2[cH]1	PADEL_KR1871
PADEL_KR1872	[!#1]c1[cH][cH]c2n([!#1])c3[cH][cH]c([!#1])[cH]c3c2[cH]1	PADEL_KR1872
PADEL_KR1873	[!#1]c1[cH][cH]c2N([CH2][CH3])C(=O)c3[cH][cH][cH]c1c23	PADEL_KR1873
PADEL_KR1874	[!#1]c1[cH][cH]c2n[cH][cH][cH]c2[cH]1	PADEL_KR1874
PADEL_KR1875	[!#1]c1[cH][cH]c2n[cH][nH]c2[cH]1	PADEL_KR1875
PADEL_KR1876	[!#1]c1[cH][cH]c2n[cH]nc3-c4[cH][cH][cH][cH]c4C(=O)c1c32	PADEL_KR1876
PADEL_KR1877	[!#1]c1[cH][cH]c2N=C(c3[cH][cH][cH][cH][cH]3)c4[cH]c([!#1])[cH][cH]c4N=C(c5[cH][cH][cH][cH][cH]5)c2[cH]1	PADEL_KR1877
PADEL_KR1878	[!#1]c1[cH][cH]c2n3[CH2][CH2][CH2]c3nc2[cH]1	PADEL_KR1878
PADEL_KR1879	[!#1]c1[cH][cH]c2n3[CH2][CH2][NH][CH]4[CH2][CH2][CH2]c(c43)c2[cH]1	PADEL_KR1879
PADEL_KR1880	[!#1]c1[cH][cH]c2nc([CH3])[nH]c2[cH]1	PADEL_KR1880
PADEL_KR1881	[!#1]c1[cH][cH]c2nc(nc(c3[cH][cH][cH][cH][cH]3)c2[cH]1)c4[cH][cH]c([cH][cH]4)c5nc(c6[cH][cH][cH][cH][cH]6)c7[cH]c([!#1])[cH][cH]c7n5	PADEL_KR1881
PADEL_KR1882	[!#1]c1[cH][cH]c2nc(oc(=O)c2[cH]1)c3[cH][cH][cH][cH][cH]3	PADEL_KR1882
PADEL_KR1883	[!#1]c1[cH][cH]c2nc3[cH][cH][cH][cH]c3[n+]([!#1])c2[cH]1	PADEL_KR1883
PADEL_KR1884	[!#1]c1[cH][cH]c2nc3[CH2][CH2][CH2][CH2]c3n2[cH]1	PADEL_KR1884
PADEL_KR1885	[!#1]c1[cH][cH]c2nc3c([cH]c2[cH]1)n([!#1])c4[cH][cH][cH][cH]c43	PADEL_KR1885
PADEL_KR1886	[!#1]c1[cH][cH]c2nc3c(=O)[nH]c(=O)nc3[nH]c2[cH]1	PADEL_KR1886
PADEL_KR1887	[!#1]c1[cH][cH]c2nc3c(=O)n([!#1])c(=O)[nH]c3nc2[cH]1	PADEL_KR1887
PADEL_KR1888	[!#1]c1[cH][cH]c2nn(nc2[cH]1)c3[cH][cH][cH][cH][cH]3	PADEL_KR1888
PADEL_KR1889	[!#1]c1[cH][cH]c2nn[nH]c2[cH]1	PADEL_KR1889
PADEL_KR1890	[!#1]c1[cH][cH]c2nonc2c1[!#1]	PADEL_KR1890
PADEL_KR1891	[!#1]c1[cH][cH]c2nsnc2c1[N+](=O)[O-]	PADEL_KR1891
PADEL_KR1892	[!#1]c1[cH][cH]c2o[cH]nc2[cH]1	PADEL_KR1892
PADEL_KR1893	[!#1]c1[cH][cH]c2O[CH2][CH2]O[CH2][CH2]O[CH2][CH2]O[CH2][CH2]O[CH2][CH2]Oc2[cH]1	PADEL_KR1893
PADEL_KR1894	[!#1]c1[cH][cH]c2O[CH2][CH2]Oc2[cH]1	PADEL_KR1894
PADEL_KR1895	[!#1]c1[cH][cH]c2O[CH2]Oc2[cH]1	PADEL_KR1895
PADEL_KR1896	[!#1]c1[cH][cH]c2oc(nc2[cH]1)c3[cH][cH][cH][cH][cH]3	PADEL_KR1896
PADEL_KR1897	[!#1]c1[cH][cH]c2oc(nc2[cH]1)c3[cH][cH][cH][cH]c3[!#1]	PADEL_KR1897
PADEL_KR1898	[!#1]c1[cH][cH]c2oc(nc2[cH]1)c3[cH][cH][cH]n[cH]3	PADEL_KR1898
PADEL_KR1899	[!#1]c1[cH][cH]c2oc(nc2[cH]1)c3[cH][cH]c([!#1])c([!#1])[cH]3	PADEL_KR1899
PADEL_KR1900	[!#1]c1[cH][cH]c2oc(nc2[cH]1)c3[cH][cH]c([CH2][CH3])[cH][cH]3	PADEL_KR1900
PADEL_KR1901	[!#1]c1[cH][cH]c2oc(nc2[cH]1)c3[cH][cH]c(c4nc5[cH]c([!#1])[cH][cH]c5o4)c6[cH][cH][cH][cH]c36	PADEL_KR1901
PADEL_KR1902	[!#1]c1[cH][cH]c2oc3[cH][cH]c([!#1])[cH]c3c2[cH]1	PADEL_KR1902
PADEL_KR1903	[!#1]c1[cH][cH]c2S(=O)c3[cH][cH][cH][cH]c3[NH]c2[cH]1	PADEL_KR1903
PADEL_KR1904	[!#1]c1[cH][cH]c2sc([CH3])nc2[cH]1	PADEL_KR1904
PADEL_KR1905	[!#1]c1[cH][cH]n([!#1])n1	PADEL_KR1905
PADEL_KR1906	[!#1]c1[cH][cH]n(n1)c2[cH][cH][cH][cH][cH]2	PADEL_KR1906
PADEL_KR1907	[!#1]c1[cH][cH]n[cH][cH]1	PADEL_KR1907
PADEL_KR1908	[!#1]c1[cH][cH]n[nH]1	PADEL_KR1908
PADEL_KR1909	[!#1]c1[cH][cH]nc([!#1])[cH]1	PADEL_KR1909
PADEL_KR1910	[!#1]c1[cH][cH]nc([!#1])n1	PADEL_KR1910
PADEL_KR1911	[!#1]c1[cH][cH]nc2[cH][cH][cH][cH]c12	PADEL_KR1911
PADEL_KR1912	[!#1]c1[cH][cH]nc2[cH]c3[cH][cH][cH][cH]c3[cH]c12	PADEL_KR1912
PADEL_KR1913	[!#1]c1[cH][cH]nn1[!#1]	PADEL_KR1913
PADEL_KR1914	[!#1]c1[cH][cH]nn1[CH3]	PADEL_KR1914
PADEL_KR1915	[!#1]c1[cH][cH]o[cH]1	PADEL_KR1915
PADEL_KR1916	[!#1]c1[cH][cH]s[cH]1	PADEL_KR1916
PADEL_KR1917	[!#1]c1[cH][cH]sc1[!#1]	PADEL_KR1917
PADEL_KR1918	[!#1]c1[cH][cH]sc1c2[cH][cH][cH][cH][cH]2	PADEL_KR1918
PADEL_KR1919	[!#1]c1[cH][nH]c(=O)[nH]c1=O	PADEL_KR1919
PADEL_KR1920	[!#1]c1[cH][nH]c2[cH][cH][cH][cH]c12	PADEL_KR1920
PADEL_KR1921	[!#1]c1[cH][nH]c2[cH][cH][cH]nc12	PADEL_KR1921
PADEL_KR1922	[!#1]c1[cH][nH]c2[cH][cH]c([!#1])[cH]c12	PADEL_KR1922
PADEL_KR1923	[!#1]c1[cH][nH]c2[cH][cH]c(O[CH3])[cH]c12	PADEL_KR1923
PADEL_KR1924	[!#1]c1[cH][nH]c2c([!#1])[cH][cH][cH]c12	PADEL_KR1924
PADEL_KR1925	[!#1]c1[cH][nH]nc1c2[cH][cH][cH][cH][cH]2	PADEL_KR1925
PADEL_KR1926	[!#1]c1[cH]c([!#1])[cH]c([!#1])[cH]1	PADEL_KR1926
PADEL_KR1927	[!#1]c1[cH]c([!#1])[cH]c([cH]1)N2C(=O)c3[cH][cH][cH][cH]c3C2=O	PADEL_KR1927
PADEL_KR1928	[!#1]c1[cH]c([!#1])[cH]c([CH3])[cH]1	PADEL_KR1928
PADEL_KR1929	[!#1]c1[cH]c([!#1])[nH]c(=O)n1	PADEL_KR1929
PADEL_KR1930	[!#1]c1[cH]c([!#1])[nH]n1	PADEL_KR1930
PADEL_KR1931	[!#1]c1[cH]c([!#1])c([!#1])[cH]c1[!#1]	PADEL_KR1931
PADEL_KR1932	[!#1]c1[cH]c([!#1])c([!#1])c([!#1])[cH]1	PADEL_KR1932
PADEL_KR1933	[!#1]c1[cH]c([!#1])c([!#1])c([!#1])c1[!#1]	PADEL_KR1933
PADEL_KR1934	[!#1]c1[cH]c([!#1])c([!#1])c([!#1])n1	PADEL_KR1934
PADEL_KR1935	[!#1]c1[cH]c([!#1])c([!#1])c(=O)[nH]1	PADEL_KR1935
PADEL_KR1936	[!#1]c1[cH]c([!#1])c([!#1])c(=O)o1	PADEL_KR1936
PADEL_KR1937	[!#1]c1[cH]c([!#1])c([!#1])s1	PADEL_KR1937
PADEL_KR1938	[!#1]c1[cH]c([!#1])c([OH])c(n1)C([CH3])([CH3])[CH3]	PADEL_KR1938
PADEL_KR1939	[!#1]c1[cH]c([!#1])c2[cH][cH][cH][cH]c2c1[!#1]	PADEL_KR1939
PADEL_KR1940	[!#1]c1[cH]c([!#1])c2[cH][cH][cH][cH]c2n1	PADEL_KR1940
PADEL_KR1941	[!#1]c1[cH]c([!#1])c2[cH][cH][cH]nc2c1[!#1]	PADEL_KR1941
PADEL_KR1942	[!#1]c1[cH]c([!#1])c2n([!#1])n[cH][n+]2n1	PADEL_KR1942
PADEL_KR1943	[!#1]c1[cH]c([!#1])n([!#1])c(=O)c1[!#1]	PADEL_KR1943
PADEL_KR1944	[!#1]c1[cH]c([!#1])n([!#1])c(=O)n1	PADEL_KR1944
PADEL_KR1945	[!#1]c1[cH]c([!#1])n([!#1])n1	PADEL_KR1945
PADEL_KR1946	[!#1]c1[cH]c([!#1])n(n1)c2[cH][cH][cH][cH][cH]2	PADEL_KR1946
PADEL_KR1947	[!#1]c1[cH]c([!#1])nc([!#1])n1	PADEL_KR1947
PADEL_KR1948	[!#1]c1[cH]c([!#1])on1	PADEL_KR1948
PADEL_KR1949	[!#1]c1[cH]c([cH][cH]c1[CH3])[CH]([CH3])[CH3]	PADEL_KR1949
PADEL_KR1950	[!#1]c1[cH]c([cH][cH]c1[CH3])[N+](=O)[O-]	PADEL_KR1950
PADEL_KR1951	[!#1]c1[cH]c([cH][cH]c1[OH])[N+](=O)[O-]	PADEL_KR1951
PADEL_KR1952	[!#1]c1[cH]c([cH][cH]c1[OH])S(=O)(=O)c2[cH][cH]c([OH])c([!#1])[cH]2	PADEL_KR1952
PADEL_KR1953	[!#1]c1[cH]c([cH][cH]c1C(=O)[OH])[N+](=O)[O-]	PADEL_KR1953
PADEL_KR1954	[!#1]c1[cH]c([cH][cH]c1C(=O)[OH])C(=O)[OH]	PADEL_KR1954
PADEL_KR1955	[!#1]c1[cH]c([cH][cH]c1Cl)[N+](=O)[O-]	PADEL_KR1955
PADEL_KR1956	[!#1]c1[cH]c([cH][cH]c1Cl)C(F)(F)F	PADEL_KR1956
PADEL_KR1957	[!#1]c1[cH]c([cH][cH]c1O[CH3])[N+](=O)[O-]	PADEL_KR1957
PADEL_KR1958	[!#1]c1[cH]c([cH]c([cH]1)[N+](=O)[O-])[N+](=O)[O-]	PADEL_KR1958
PADEL_KR1959	[!#1]c1[cH]c([cH]c([cH]1)C([CH3])([CH3])[CH3])C([CH3])([CH3])[CH3]	PADEL_KR1959
PADEL_KR1960	[!#1]c1[cH]c([cH]c([cH]1)C(=O)[OH])C(=O)[OH]	PADEL_KR1960
PADEL_KR1961	[!#1]c1[cH]c([cH]c(c1[OH])C([CH3])([CH3])[CH3])C([CH3])([CH3])[CH3]	PADEL_KR1961
PADEL_KR1962	[!#1]c1[cH]c([CH3])[cH][cH]c1[CH]([CH3])[CH3]	PADEL_KR1962
PADEL_KR1963	[!#1]c1[cH]c([CH3])[cH][cH]c1[CH3]	PADEL_KR1963
PADEL_KR1964	[!#1]c1[cH]c([CH3])[cH][cH]n1	PADEL_KR1964
PADEL_KR1965	[!#1]c1[cH]c([CH3])[cH]c([CH3])[cH]1	PADEL_KR1965
PADEL_KR1966	[!#1]c1[cH]c([CH3])c(Br)[cH]c1[CH]([CH3])[CH3]	PADEL_KR1966
PADEL_KR1967	[!#1]c1[cH]c([CH3])c(Cl)c([CH3])[cH]1	PADEL_KR1967
PADEL_KR1968	[!#1]c1[cH]c([CH3])n[nH]1	PADEL_KR1968
PADEL_KR1969	[!#1]c1[cH]c([CH3])nc([!#1])c1[OH]	PADEL_KR1969
PADEL_KR1970	[!#1]c1[cH]c([CH3])nc2[cH][cH][cH][cH]c12	PADEL_KR1970
PADEL_KR1971	[!#1]c1[cH]c([N+](=O)[O-])c([CH3])c([cH]1)[N+](=O)[O-]	PADEL_KR1971
PADEL_KR1972	[!#1]c1[cH]c([N+](=O)[O-])c(Cl)[cH]c1Cl	PADEL_KR1972
PADEL_KR1973	[!#1]c1[cH]c([nH]n1)c2[cH][cH][cH][cH][cH]2	PADEL_KR1973
PADEL_KR1974	[!#1]c1[cH]c([OH])[cH][cH]c1[OH]	PADEL_KR1974
PADEL_KR1975	[!#1]c1[cH]c([OH])[cH]c([OH])[cH]1	PADEL_KR1975
PADEL_KR1976	[!#1]c1[cH]c(=O)[nH]c([!#1])n1	PADEL_KR1976
PADEL_KR1977	[!#1]c1[cH]c(=O)oc2[cH][cH][cH][cH]c12	PADEL_KR1977
PADEL_KR1978	[!#1]c1[cH]c(=O)oc2[cH][cH]c([cH]c12)[N+](=O)[O-]	PADEL_KR1978
PADEL_KR1979	[!#1]c1[cH]c(Br)[cH]c(Br)c1[!#1]	PADEL_KR1979
PADEL_KR1980	[!#1]c1[cH]c(Br)[cH]c(Br)c1[OH]	PADEL_KR1980
PADEL_KR1981	[!#1]c1[cH]c(Br)[cH]c(C(=O)[OH])c1[!#1]	PADEL_KR1981
PADEL_KR1982	[!#1]c1[cH]c(Br)c([OH])c(Br)[cH]1	PADEL_KR1982
PADEL_KR1983	[!#1]c1[cH]c(c([OH])c([cH]1)C([CH3])([CH3])[CH3])C([CH3])([CH3])[CH3]	PADEL_KR1983
PADEL_KR1984	[!#1]c1[cH]c(C(=O)[OH])c([!#1])[cH]c1C(=O)[OH]	PADEL_KR1984
PADEL_KR1985	[!#1]c1[cH]c(Cl)[cH][cH]c1[OH]	PADEL_KR1985
PADEL_KR1986	[!#1]c1[cH]c(Cl)[cH][cH]c1Cl	PADEL_KR1986
PADEL_KR1987	[!#1]c1[cH]c(Cl)[cH]c(Cl)[cH]1	PADEL_KR1987
PADEL_KR1988	[!#1]c1[cH]c(Cl)[cH]c(Cl)c1O[CH3]	PADEL_KR1988
PADEL_KR1989	[!#1]c1[cH]c(Cl)c([!#1])c(Cl)[cH]1	PADEL_KR1989
PADEL_KR1990	[!#1]c1[cH]c(Cl)c(Cl)[cH]c1Cl	PADEL_KR1990
PADEL_KR1991	[!#1]c1[cH]c(n[nH]1)c2[cH][cH][cH][cH][cH]2	PADEL_KR1991
PADEL_KR1992	[!#1]c1[cH]c(n[nH]1)c2[cH][cH]c([!#1])[cH][cH]2	PADEL_KR1992
PADEL_KR1993	[!#1]c1[cH]c(nc2[cH][cH][cH][cH]c12)c3[cH][cH][cH][cH][cH]3	PADEL_KR1993
PADEL_KR1994	[!#1]c1[cH]c(nc2[cH][cH][cH][cH]c12)N([CH3])[CH3]	PADEL_KR1994
PADEL_KR1995	[!#1]c1[cH]c(nn1c2[cH][cH][cH][cH][cH]2)c3[cH][cH][cH][cH][cH]3	PADEL_KR1995
PADEL_KR1996	[!#1]c1[cH]c(nn1c2[cH][cH][cH][cH][cH]2)c3[cH][cH]c([!#1])[cH][cH]3	PADEL_KR1996
PADEL_KR1997	[!#1]c1[cH]c(O[CH3])[cH][cH]c1O[CH3]	PADEL_KR1997
PADEL_KR1998	[!#1]c1[cH]c(O[CH3])[cH]c(O[CH3])[cH]1	PADEL_KR1998
PADEL_KR1999	[!#1]c1[cH]c(O[CH3])c(O[CH3])[cH]c1[!#1]	PADEL_KR1999
PADEL_KR2000	[!#1]c1[cH]c(O[CH3])c(O[CH3])c(O[CH3])[cH]1	PADEL_KR2000
PADEL_KR2001	[!#1]c1[cH]c(O[CH3])nc(O[CH3])n1	PADEL_KR2001
PADEL_KR2002	[!#1]c1[cH]c2[cH][cH][cH][cH]c2[cH]c1[!#1]	PADEL_KR2002
PADEL_KR2003	[!#1]c1[cH]c2[cH][cH][cH][cH]c2[cH]c1[OH]	PADEL_KR2003
PADEL_KR2004	[!#1]c1[cH]c2[cH][cH][cH][cH]c2[cH]c1O[CH3]	PADEL_KR2004
PADEL_KR2005	[!#1]c1[cH]c2[cH][cH][cH][cH]c2[nH]1	PADEL_KR2005
PADEL_KR2006	[!#1]c1[cH]c2[cH][cH][cH][cH]c2nc1[!#1]	PADEL_KR2006
PADEL_KR2007	[!#1]c1[cH]c2[cH][cH][cH][cH]c2o1	PADEL_KR2007
PADEL_KR2008	[!#1]c1[cH]c2[cH][cH][cH][cH]c2oc1=O	PADEL_KR2008
PADEL_KR2009	[!#1]c1[cH]c2C(=N[OH])[CH2][CH2][CH2][CH2]c2s1	PADEL_KR2009
PADEL_KR2010	[!#1]c1[cH]c2nc3[cH][cH][cH][cH]c3nc2[cH]c1[!#1]	PADEL_KR2010
PADEL_KR2011	[!#1]c1[cH]c2O[CH2][CH2]Oc2[cH]c1[!#1]	PADEL_KR2011
PADEL_KR2012	[!#1]c1[cH]c2O[CH2]Oc2[cH]c1[!#1]	PADEL_KR2012
PADEL_KR2013	[!#1]c1[cH]n([!#1])c2[cH][cH][cH][cH]c12	PADEL_KR2013
PADEL_KR2014	[!#1]c1[cH]n([!#1])c2[cH][cH]c([!#1])[cH]c12	PADEL_KR2014
PADEL_KR2015	[!#1]c1[cH]n([!#1])nc1[!#1]	PADEL_KR2015
PADEL_KR2016	[!#1]c1[cH]n(C(=O)[CH3])c2[cH][cH][cH][cH]c12	PADEL_KR2016
PADEL_KR2017	[!#1]c1[cH]n(nc1c2[cH][cH][cH][cH][cH]2)c3[cH][cH][cH][cH][cH]3	PADEL_KR2017
PADEL_KR2018	[!#1]c1[cH]n[cH]c([!#1])[cH]1	PADEL_KR2018
PADEL_KR2019	[!#1]c1[cH]n[cH]c(Br)[cH]1	PADEL_KR2019
PADEL_KR2020	[!#1]c1[cH]n[nH]c1[!#1]	PADEL_KR2020
PADEL_KR2021	[!#1]c1[cH]n2[cH][cH][cH][cH]c2n1	PADEL_KR2021
PADEL_KR2022	[!#1]c1[cH]n2[CH2][CH2][CH2]c2n1	PADEL_KR2022
PADEL_KR2023	[!#1]c1[cH]n2c(n1)n([!#1])c3[cH][cH][cH][cH]c32	PADEL_KR2023
PADEL_KR2024	[!#1]c1[cH]nc([!#1])c([!#1])[cH]1	PADEL_KR2024
PADEL_KR2025	[!#1]c1[cH]nc([!#1])n[cH]1	PADEL_KR2025
PADEL_KR2026	[!#1]c1[cH]nc([!#1])n1[!#1]	PADEL_KR2026
PADEL_KR2027	[!#1]c1[cH]nc([!#1])o1	PADEL_KR2027
PADEL_KR2028	[!#1]c1[cH]nc2[cH][cH][cH][cH]c2[cH]1	PADEL_KR2028
PADEL_KR2029	[!#1]c1[cH]nc2[cH][cH][cH][cH]c2n1	PADEL_KR2029
PADEL_KR2030	[!#1]c1[cH]nn([!#1])c1[!#1]	PADEL_KR2030
PADEL_KR2031	[!#1]c1[cH]nn([cH]1)c2[cH][cH][cH][cH][cH]2	PADEL_KR2031
PADEL_KR2032	[!#1]c1[cH]oc2[cH][cH]c([!#1])c([!#1])c12	PADEL_KR2032
PADEL_KR2033	[!#1]c1[cH]oc2c1[cH]c([!#1])c3[cH][cH][cH][cH]c23	PADEL_KR2033
PADEL_KR2034	[!#1]c1[cH]sc([!#1])n1	PADEL_KR2034
PADEL_KR2035	[!#1]c1[cH]sc([NH2])n1	PADEL_KR2035
PADEL_KR2036	[!#1]c1[n+]([!#1])[cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR2036
PADEL_KR2037	[!#1]c1[nH]c([!#1])c([!#1])c1[!#1]	PADEL_KR2037
PADEL_KR2038	[!#1]c1[nH]c2[cH][cH][cH][cH]c2c1[!#1]	PADEL_KR2038
PADEL_KR2039	[!#1]c1[nH]c2[cH][cH]c([!#1])[cH]c2c1[!#1]	PADEL_KR2039
PADEL_KR2040	[!#1]c1[nH]n[cH]c1I	PADEL_KR2040
PADEL_KR2041	[!#1]c1[nH]nc([CH3])c1[N+](=O)[O-]	PADEL_KR2041
PADEL_KR2042	[!#1]c1[nH]nc([CH3])c1Br	PADEL_KR2042
PADEL_KR2043	[!#1]C1=[CH][CH2][CH2][CH2][CH2]1	PADEL_KR2043
PADEL_KR2044	[!#1]C1=[CH][NH][CH]2[CH]=[CH][CH]=[CH][CH]21	PADEL_KR2044
PADEL_KR2045	[!#1]C1=[CH]C(=O)[CH]=[CH]C1=O	PADEL_KR2045
PADEL_KR2046	[!#1]C1=[CH]C(=O)[CH2]C([!#1])([CH3])[CH2]1	PADEL_KR2046
PADEL_KR2047	[!#1]C1=[CH]C(=O)[CH2]C([CH3])([CH3])[CH2]1	PADEL_KR2047
PADEL_KR2048	[!#1]C1=[CH]C(=O)c2[cH][cH][cH][cH]c2C1=O	PADEL_KR2048
PADEL_KR2049	[!#1]C1=[CH]C(=O)OC21[CH2][CH2][CH2][CH2][CH2]2	PADEL_KR2049
PADEL_KR2050	[!#1]C1=[CH]O[CH2][CH2]O1	PADEL_KR2050
PADEL_KR2051	[!#1]C1=C([!#1])[CH]([NH]C(=O)[NH]1)c2[cH][cH][cH][cH][cH]2	PADEL_KR2051
PADEL_KR2052	[!#1]C1=C([!#1])[CH]([NH]C(=O)[NH]1)c2[cH][cH][cH]c([!#1])[cH]2	PADEL_KR2052
PADEL_KR2053	[!#1]C1=C([!#1])[CH](C2=C([CH2]C([!#1])([CH3])[CH2]C2=O)[NH]1)c3[cH][cH][cH]c([!#1])[cH]3	PADEL_KR2053
PADEL_KR2054	[!#1]C1=C([!#1])C(=O)[CH2]C([!#1])([CH3])[CH2]1	PADEL_KR2054
PADEL_KR2055	[!#1]C1=C([!#1])C(=O)c2[cH][cH][cH][cH]c2C1=O	PADEL_KR2055
PADEL_KR2056	[!#1]C1=C([OH])[CH2]C([CH3])([CH3])[CH2]C1=O	PADEL_KR2056
PADEL_KR2057	[!#1]C1=C([OH])C(=O)c2[cH][cH][cH][cH]c2C1=O	PADEL_KR2057
PADEL_KR2058	[!#1]C1=C(C(=O)c2[cH][cH][cH][cH]c12)c3[cH][cH][cH][cH][cH]3	PADEL_KR2058
PADEL_KR2059	[!#1]C1=C2[NH]c3[cH][cH][cH][cH]c3N2[CH2][CH2]C1=O	PADEL_KR2059
PADEL_KR2060	[!#1]C1=N[CH2][CH2][NH]1	PADEL_KR2060
PADEL_KR2061	[!#1]C1=N[CH2][CH2]c2[cH][cH][cH][cH]c12	PADEL_KR2061
PADEL_KR2062	[!#1]C1=N[CH2][CH2]n2[cH][cH][cH]c12	PADEL_KR2062
PADEL_KR2063	[!#1]C1=N[NH]C([CH2]1)(c2[cH][cH][cH][cH][cH]2)c3[cH][cH][cH][cH][cH]3	PADEL_KR2063
PADEL_KR2064	[!#1]C1=Nc2[cH][cH][cH][cH]c2[CH2][CH2][CH2]1	PADEL_KR2064
PADEL_KR2065	[!#1]C12[CH2][CH2][CH2][CH]2[CH]3[CH2][CH2][CH]1[CH2]3	PADEL_KR2065
PADEL_KR2066	[!#1]c1c([!#1])c([!#1])c([!#1])c([!#1])c1[!#1]	PADEL_KR2066
PADEL_KR2067	[!#1]c1c([!#1])c(=O)n(c2[cH][cH][cH][cH][cH]2)n1[!#1]	PADEL_KR2067
PADEL_KR2068	[!#1]c1c([!#1])c2[cH][cH][cH][cH]c2n1[!#1]	PADEL_KR2068
PADEL_KR2069	[!#1]c1c([!#1])c2[cH][cH][cH][cH]c2oc1=O	PADEL_KR2069
PADEL_KR2070	[!#1]c1c([!#1])c2[cH][cH][cH][cH]c2sc1=O	PADEL_KR2070
PADEL_KR2071	[!#1]c1c([!#1])c2[cH]c([!#1])[cH][cH]c2n1[!#1]	PADEL_KR2071
PADEL_KR2072	[!#1]c1c([!#1])c2[cH]c([!#1])[cH][cH]c2n1c3[cH][cH][cH][cH][cH]3	PADEL_KR2072
PADEL_KR2073	[!#1]c1c([!#1])c2[cH]c([!#1])c([!#1])[cH]c2n1[!#1]	PADEL_KR2073
PADEL_KR2074	[!#1]c1c([cH][cH][cH]c1[N+](=O)[O-])C(=O)[OH]	PADEL_KR2074
PADEL_KR2075	[!#1]c1c([cH][cH]c2nonc12)[N+](=O)[O-]	PADEL_KR2075
PADEL_KR2076	[!#1]c1c([cH]c([cH]c1[CH]([CH3])[CH3])[CH]([CH3])[CH3])[CH]([CH3])[CH3]	PADEL_KR2076
PADEL_KR2077	[!#1]c1c([cH]c([cH]c1[N+](=O)[O-])C(=O)[OH])[N+](=O)[O-]	PADEL_KR2077
PADEL_KR2078	[!#1]c1c([cH]c([cH]c1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]	PADEL_KR2078
PADEL_KR2079	[!#1]c1c([cH]c([CH3])[cH]c1[N+](=O)[O-])[N+](=O)[O-]	PADEL_KR2079
PADEL_KR2080	[!#1]c1c([cH]c([N+](=O)[O-])c2[cH][cH][cH]nc12)[N+](=O)[O-]	PADEL_KR2080
PADEL_KR2081	[!#1]c1c([cH]nn1[CH3])[N+](=O)[O-]	PADEL_KR2081
PADEL_KR2082	[!#1]c1c([CH3])[cH][cH][cH]c1[CH3]	PADEL_KR2082
PADEL_KR2083	[!#1]c1c([CH3])[cH][cH]c([CH3])c1[CH3]	PADEL_KR2083
PADEL_KR2084	[!#1]c1c([CH3])[cH]c([CH3])[cH]c1[CH3]	PADEL_KR2084
PADEL_KR2085	[!#1]c1c([CH3])[cH]c([CH3])c([CH]=N[OH])c1[CH3]	PADEL_KR2085
PADEL_KR2086	[!#1]c1c([CH3])[cH]c(Br)[cH]c1[CH3]	PADEL_KR2086
PADEL_KR2087	[!#1]c1c([CH3])[nH]c2[cH][cH][cH][cH]c12	PADEL_KR2087
PADEL_KR2088	[!#1]c1c([CH3])c([CH2][CH3])nc2[cH][cH][cH][cH]c12	PADEL_KR2088
PADEL_KR2089	[!#1]c1c([CH3])n([!#1])n([!#1])c1=O	PADEL_KR2089
PADEL_KR2090	[!#1]c1c([CH3])n([CH3])n(c2[cH][cH][cH][cH][cH]2)c1=O	PADEL_KR2090
PADEL_KR2091	[!#1]c1c([CH3])nn([!#1])c1[CH3]	PADEL_KR2091
PADEL_KR2092	[!#1]c1c([N+](=O)[O-])c([!#1])c([N+](=O)[O-])c([!#1])c1[N+](=O)[O-]	PADEL_KR2092
PADEL_KR2093	[!#1]c1c([nH]c2[cH][cH]c([!#1])[cH]c12)C(=O)[OH]	PADEL_KR2093
PADEL_KR2094	[!#1]c1c([OH])[cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR2094
PADEL_KR2095	[!#1]c1c([OH])[cH]c([OH])[cH]c1[OH]	PADEL_KR2095
PADEL_KR2096	[!#1]c1c([OH])c2[cH][cH][cH][cH]c2oc1=O	PADEL_KR2096
PADEL_KR2097	[!#1]c1c([OH])c2[cH][cH][cH][cH]c2sc1=O	PADEL_KR2097
PADEL_KR2098	[!#1]c1c(Br)[cH]c(Br)[cH]c1Br	PADEL_KR2098
PADEL_KR2099	[!#1]c1c(Br)[cH]c(Br)c2[cH][cH][cH]nc12	PADEL_KR2099
PADEL_KR2100	[!#1]c1c(c2[cH][cH][cH][cH][cH]2)c3[cH]c([!#1])[cH][cH]c3n1[!#1]	PADEL_KR2100
PADEL_KR2101	[!#1]c1c(Cl)[cH][cH][cH]c1Cl	PADEL_KR2101
PADEL_KR2102	[!#1]c1c(Cl)[cH]c(Cl)[cH]c1Cl	PADEL_KR2102
PADEL_KR2103	[!#1]c1c(F)[cH][cH][cH]c1F	PADEL_KR2103
PADEL_KR2104	[!#1]c1c(F)c(F)c([!#1])c(F)c1F	PADEL_KR2104
PADEL_KR2105	[!#1]c1c(F)c(F)c(F)c(F)c1F	PADEL_KR2105
PADEL_KR2106	[!#1]c1c(n[cH]n1[CH3])[N+](=O)[O-]	PADEL_KR2106
PADEL_KR2107	[!#1]c1c(nc([CH3])n1[!#1])[N+](=O)[O-]	PADEL_KR2107
PADEL_KR2108	[!#1]c1c2[CH]([OH])[CH2]C([CH3])([CH3])[CH2]c2nc3[cH][cH][cH][cH]c13	PADEL_KR2108
PADEL_KR2109	[!#1]c1c2[cH][cH][cH][cH]c2[cH]c3[cH][cH][cH][cH]c13	PADEL_KR2109
PADEL_KR2110	[!#1]c1c2[cH][cH][cH][cH]c2c([!#1])c3[cH][cH][cH][cH]c13	PADEL_KR2110
PADEL_KR2111	[!#1]c1c2[cH][cH][cH][cH]c2n3c([CH3])nc4[cH][cH][cH][cH]c4c13	PADEL_KR2111
PADEL_KR2112	[!#1]c1c2[cH][cH][cH][cH]c2nc3[cH][cH][cH][cH]c13	PADEL_KR2112
PADEL_KR2113	[!#1]c1c2[CH2][CH2][CH2][CH2]c2nc3[cH][cH][cH][cH]c13	PADEL_KR2113
PADEL_KR2114	[!#1]c1c2[CH2][CH2][CH2]c2nc3[cH][cH][cH][cH]c13	PADEL_KR2114
PADEL_KR2115	[!#1]c1c2[CH2][CH2][CH2]c2nc3[CH2][CH2][CH2][CH2]c13	PADEL_KR2115
PADEL_KR2116	[!#1]c1c2[CH2][CH2][CH2]c2nc3[CH2][CH2][CH2]c31	PADEL_KR2116
PADEL_KR2117	[!#1]c1c2[CH2][CH2]N([CH3])c2nc3[cH][cH][cH][cH]c13	PADEL_KR2117
PADEL_KR2118	[!#1]c1c2C(=O)[CH2]C([!#1])([CH3])[CH2]c2nc3[cH][cH][cH][cH]c13	PADEL_KR2118
PADEL_KR2119	[!#1]c1c2C(=O)[CH2]C([CH3])([CH3])[CH2]c2nc3[cH][cH][cH][cH]c13	PADEL_KR2119
PADEL_KR2120	[!#1]c1n([!#1])c2[cH][cH][cH][cH]c2[n+]1[!#1]	PADEL_KR2120
PADEL_KR2121	[!#1]c1n([!#1])c2[cH][cH]c([!#1])[cH]c2[n+]1[!#1]	PADEL_KR2121
PADEL_KR2122	[!#1]c1n([CH3])c2[cH][cH][cH][cH]c2[n+]1[CH3]	PADEL_KR2122
PADEL_KR2123	[!#1]c1n[cH][cH][cH]c1[CH3]	PADEL_KR2123
PADEL_KR2124	[!#1]c1n[cH][cH][cH]c1[OH]	PADEL_KR2124
PADEL_KR2125	[!#1]c1n[cH][cH][cH]n1	PADEL_KR2125
PADEL_KR2126	[!#1]c1n[cH][cH]c(n1)c2[cH][cH][cH][cH][cH]2	PADEL_KR2126
PADEL_KR2127	[!#1]c1n[cH][cH]n1[!#1]	PADEL_KR2127
PADEL_KR2128	[!#1]c1n[cH][cH]nc1[!#1]	PADEL_KR2128
PADEL_KR2129	[!#1]c1n[cH][cH]nc1C(=O)[OH]	PADEL_KR2129
PADEL_KR2130	[!#1]c1n[cH][cH]nc1O[CH3]	PADEL_KR2130
PADEL_KR2131	[!#1]c1n[cH][cH]s1	PADEL_KR2131
PADEL_KR2132	[!#1]c1n[cH][nH]c1[!#1]	PADEL_KR2132
PADEL_KR2133	[!#1]c1n[cH][nH]n1	PADEL_KR2133
PADEL_KR2134	[!#1]c1n[cH]c(s1)c2[cH][cH][cH][cH][cH]2	PADEL_KR2134
PADEL_KR2135	[!#1]c1n[cH]n([!#1])c1[!#1]	PADEL_KR2135
PADEL_KR2136	[!#1]c1n[cH]n[nH]1	PADEL_KR2136
PADEL_KR2137	[!#1]c1n[cH]nc([!#1])c1[!#1]	PADEL_KR2137
PADEL_KR2138	[!#1]c1n[cH]nc2[nH][cH]nc12	PADEL_KR2138
PADEL_KR2139	[!#1]c1n[cH]nc2n[cH][nH]c12	PADEL_KR2139
PADEL_KR2140	[!#1]c1n[cH]nc2sc([CH3])c([CH3])c12	PADEL_KR2140
PADEL_KR2141	[!#1]c1n[cH]nc2sc3[CH2][CH2][CH2][CH2]c3c12	PADEL_KR2141
PADEL_KR2142	[!#1]c1n[nH]c([!#1])c1[!#1]	PADEL_KR2142
PADEL_KR2143	[!#1]c1n[nH]c([!#1])n1	PADEL_KR2143
PADEL_KR2144	[!#1]c1n[nH]c([NH2])n1	PADEL_KR2144
PADEL_KR2145	[!#1]c1n[nH]c(=O)[nH]c1=O	PADEL_KR2145
PADEL_KR2146	[!#1]c1n[nH]c(=O)c2[cH][cH][cH][cH]c12	PADEL_KR2146
PADEL_KR2147	[!#1]c1n[nH]c(=S)[nH]c1=O	PADEL_KR2147
PADEL_KR2148	[!#1]c1n[nH]c2[CH2][CH2][CH2][CH2]c12	PADEL_KR2148
PADEL_KR2149	[!#1]c1nc([!#1])c([!#1])[nH]1	PADEL_KR2149
PADEL_KR2150	[!#1]c1nc([!#1])c([!#1])c([!#1])n1	PADEL_KR2150
PADEL_KR2151	[!#1]c1nc([!#1])c([!#1])s1	PADEL_KR2151
PADEL_KR2152	[!#1]c1nc([!#1])c2[cH][cH][cH][cH]c2n1	PADEL_KR2152
PADEL_KR2153	[!#1]c1nc([!#1])c2c3[CH2][CH2][CH2][CH2]c3sc2n1	PADEL_KR2153
PADEL_KR2154	[!#1]c1nc([!#1])n([!#1])n1	PADEL_KR2154
PADEL_KR2155	[!#1]c1nc([!#1])nc([!#1])n1	PADEL_KR2155
PADEL_KR2156	[!#1]c1nc([!#1])nc([NH][CH3])n1	PADEL_KR2156
PADEL_KR2157	[!#1]c1nc([!#1])nc([NH]N=[CH]c2[cH][cH][cH]c([N+](=O)[O-])c2[OH])n1	PADEL_KR2157
PADEL_KR2158	[!#1]c1nc([!#1])nc(Cl)n1	PADEL_KR2158
PADEL_KR2159	[!#1]c1nc([!#1])nc(n1)N2[CH2][CH2][CH2][CH2][CH2]2	PADEL_KR2159
PADEL_KR2160	[!#1]c1nc([!#1])nc(n1)N2[CH2][CH2][NH][CH2][CH2]2	PADEL_KR2160
PADEL_KR2161	[!#1]c1nc([!#1])nc(n1)N2[CH2][CH2]O[CH2][CH2]2	PADEL_KR2161
PADEL_KR2162	[!#1]c1nc([!#1])nc(O[CH](C(F)(F)F)C(F)(F)F)n1	PADEL_KR2162
PADEL_KR2163	[!#1]c1nc([!#1])nc(O[CH3])n1	PADEL_KR2163
PADEL_KR2164	[!#1]c1nc([cH]c(n1)c2[cH][cH][cH][cH][cH]2)c3[cH][cH][cH][cH][cH]3	PADEL_KR2164
PADEL_KR2165	[!#1]c1nc([cH]s1)C2([CH2][CH]3[CH2][CH]4[CH2][CH]([CH2]3)[CH2]2)[CH2]4	PADEL_KR2165
PADEL_KR2166	[!#1]c1nc([cH]s1)c2[cH][cH][cH][cH][cH]2	PADEL_KR2166
PADEL_KR2167	[!#1]c1nc([cH]s1)c2[cH][cH]c([!#1])[cH][cH]2	PADEL_KR2167
PADEL_KR2168	[!#1]c1nc([cH]s1)c2[cH][cH]c([!#1])c([!#1])[cH]2	PADEL_KR2168
PADEL_KR2169	[!#1]c1nc([CH3])[cH][cH]c1[OH]	PADEL_KR2169
PADEL_KR2170	[!#1]c1nc([CH3])[cH]c([CH3])n1	PADEL_KR2170
PADEL_KR2171	[!#1]c1nc([CH3])[cH]s1	PADEL_KR2171
PADEL_KR2172	[!#1]c1nc([CH3])nc(O[CH3])n1	PADEL_KR2172
PADEL_KR2173	[!#1]c1nc([CH3])nc2sc3[CH2][CH2][CH2][CH2]c3c12	PADEL_KR2173
PADEL_KR2174	[!#1]c1nc([NH2])nc(Cl)n1	PADEL_KR2174
PADEL_KR2175	[!#1]c1nc([OH])[cH]c(=O)[nH]1	PADEL_KR2175
PADEL_KR2176	[!#1]c1nc(=O)c([!#1])c([!#1])[nH]1	PADEL_KR2176
PADEL_KR2177	[!#1]c1nc(c([!#1])s1)c2[cH][cH][cH][cH][cH]2	PADEL_KR2177
PADEL_KR2178	[!#1]c1nc(c([!#1])s1)c2[cH][cH]c([!#1])[cH][cH]2	PADEL_KR2178
PADEL_KR2179	[!#1]c1nc(Cl)nc(Cl)n1	PADEL_KR2179
PADEL_KR2180	[!#1]c1nc(I)[cH][cH]c1[OH]	PADEL_KR2180
PADEL_KR2181	[!#1]c1nc(nc(n1)N2[CH2][CH2]O[CH2][CH2]2)N3[CH2][CH2][CH2][CH2][CH2]3	PADEL_KR2181
PADEL_KR2182	[!#1]c1nc(nc(n1)N2[CH2][CH2]O[CH2][CH2]2)N3[CH2][CH2]O[CH2][CH2]3	PADEL_KR2182
PADEL_KR2183	[!#1]c1nc(O[CH3])nc(O[CH3])n1	PADEL_KR2183
PADEL_KR2184	[!#1]c1nc2[cH][cH][cH][cH]c2[nH]1	PADEL_KR2184
PADEL_KR2185	[!#1]c1nc2[cH][cH][cH][cH]c2[nH]c1=O	PADEL_KR2185
PADEL_KR2186	[!#1]c1nc2[cH][cH][cH][cH]c2c([!#1])c1[!#1]	PADEL_KR2186
PADEL_KR2187	[!#1]c1nc2[cH][cH][cH][cH]c2c(=O)[nH]1	PADEL_KR2187
PADEL_KR2188	[!#1]c1nc2[cH][cH][cH][cH]c2c(=O)n1c3[cH][cH][cH][cH][cH]3	PADEL_KR2188
PADEL_KR2189	[!#1]c1nc2[cH][cH][cH][cH]c2c(=O)o1	PADEL_KR2189
PADEL_KR2190	[!#1]c1nc2[cH][cH][cH][cH]c2c3[cH][cH][cH][cH]c13	PADEL_KR2190
PADEL_KR2191	[!#1]c1nc2[cH][cH][cH][cH]c2n1[!#1]	PADEL_KR2191
PADEL_KR2192	[!#1]c1nc2[cH][cH][cH][cH]c2nc1[!#1]	PADEL_KR2192
PADEL_KR2193	[!#1]c1nc2[cH][cH][cH][cH]c2o1	PADEL_KR2193
PADEL_KR2194	[!#1]c1nc2[cH][cH][cH][cH]c2s1	PADEL_KR2194
PADEL_KR2195	[!#1]c1nc2[cH][cH][cH][cH]n2c1[!#1]	PADEL_KR2195
PADEL_KR2196	[!#1]c1nc2[cH][cH]c([!#1])[cH]c2[nH]1	PADEL_KR2196
PADEL_KR2197	[!#1]c1nc2[cH][cH]c([!#1])[cH]c2o1	PADEL_KR2197
PADEL_KR2198	[!#1]c1nc2[cH][cH]c([!#1])[cH]c2s1	PADEL_KR2198
PADEL_KR2199	[!#1]c1nc2[cH][cH]c([CH3])[cH]c2s1	PADEL_KR2199
PADEL_KR2200	[!#1]c1nc2[cH]c([!#1])[cH][cH]c2[nH]1	PADEL_KR2200
PADEL_KR2201	[!#1]c1nc2[cH]c([!#1])[cH][cH]c2o1	PADEL_KR2201
PADEL_KR2202	[!#1]c1nc2[cH]c([!#1])[cH][cH]c2s1	PADEL_KR2202
PADEL_KR2203	[!#1]c1nc2[cH]c(Cl)[cH][cH]c2o1	PADEL_KR2203
PADEL_KR2204	[!#1]c1nc2n([!#1])c(=O)[nH]c(=O)c2n1[!#1]	PADEL_KR2204
PADEL_KR2205	[!#1]c1nc2n([!#1])c(=O)n([!#1])c(=O)c2n1[!#1]	PADEL_KR2205
PADEL_KR2206	[!#1]c1nc2nc([!#1])[cH]c([!#1])n2n1	PADEL_KR2206
PADEL_KR2207	[!#1]c1nc2nc([cH]c(c3[cH][cH][cH][cH][cH]3)n2n1)c4[cH][cH][cH][cH][cH]4	PADEL_KR2207
PADEL_KR2208	[!#1]c1nc2nc([CH3])[cH]c([CH3])n2n1	PADEL_KR2208
PADEL_KR2209	[!#1]c1nc2nonc2nc1[!#1]	PADEL_KR2209
PADEL_KR2210	[!#1]c1nc2sc3[CH2][CH2][CH2][CH2]c3c2c(=O)n1[!#1]	PADEL_KR2210
PADEL_KR2211	[!#1]c1nc2sc3[CH2][CH2][CH2][CH2]c3c2s1	PADEL_KR2211
PADEL_KR2212	[!#1]c1nn([!#1])c([!#1])c1[!#1]	PADEL_KR2212
PADEL_KR2213	[!#1]c1nn([CH3])[cH]c1Br	PADEL_KR2213
PADEL_KR2214	[!#1]c1nn(c([!#1])c1[!#1])c2[cH][cH][cH][cH][cH]2	PADEL_KR2214
PADEL_KR2215	[!#1]c1nn(c([!#1])c1[!#1])c2[cH][cH]c([!#1])[cH][cH]2	PADEL_KR2215
PADEL_KR2216	[!#1]c1nn[cH][nH]1	PADEL_KR2216
PADEL_KR2217	[!#1]c1nn[cH]n1c2[cH][cH][cH][cH][cH]2	PADEL_KR2217
PADEL_KR2218	[!#1]c1nnc([!#1])n1[!#1]	PADEL_KR2218
PADEL_KR2219	[!#1]c1nnc([!#1])n1c2[cH][cH][cH][cH][cH]2	PADEL_KR2219
PADEL_KR2220	[!#1]c1nnc([!#1])o1	PADEL_KR2220
PADEL_KR2221	[!#1]c1nnc([!#1])s1	PADEL_KR2221
PADEL_KR2222	[!#1]c1nnc([CH2][CH3])s1	PADEL_KR2222
PADEL_KR2223	[!#1]c1nnc([CH3])s1	PADEL_KR2223
PADEL_KR2224	[!#1]c1nnc([NH2])s1	PADEL_KR2224
PADEL_KR2225	[!#1]c1nnc2c([!#1])nc3nonc3n12	PADEL_KR2225
PADEL_KR2226	[!#1]c1nnc2c3[cH][cH][cH][cH]c3[nH]c2n1	PADEL_KR2226
PADEL_KR2227	[!#1]c1nnn[nH]1	PADEL_KR2227
PADEL_KR2228	[!#1]c1nnnn1[!#1]	PADEL_KR2228
PADEL_KR2229	[!#1]c1nnnn1c2[cH][cH][cH][cH][cH]2	PADEL_KR2229
PADEL_KR2230	[!#1]c1nnnn1c2c([!#1])[cH][cH][cH]c2[!#1]	PADEL_KR2230
PADEL_KR2231	[!#1]c1nnnn1c2c([CH3])[cH][cH][cH]c2[CH3]	PADEL_KR2231
PADEL_KR2232	[!#1]c1no[n+]([!#1])c1[!#1]	PADEL_KR2232
PADEL_KR2233	[!#1]c1nonc1[!#1]	PADEL_KR2233
PADEL_KR2234	[!#1]c1oc2[cH][cH][cH][cH]c2[n+]1[!#1]	PADEL_KR2234
PADEL_KR2235	[!#1]c1oc2[cH][cH]c([!#1])[cH]c2c1[!#1]	PADEL_KR2235
PADEL_KR2236	[!#1]c1oc2[cH][cH]c([!#1])c([!#1])c2c1[!#1]	PADEL_KR2236
PADEL_KR2237	[!#1]c1oc2[cH]c([!#1])c([!#1])[cH]c2c1[!#1]	PADEL_KR2237
PADEL_KR2238	[!#1]c1oc2c([!#1])c([!#1])c([!#1])[cH]c2c1[!#1]	PADEL_KR2238
PADEL_KR2239	[!#1]c1s[cH][n+]([!#1])c1[!#1]	PADEL_KR2239
PADEL_KR2240	[!#1]c1s[cH][n+]([!#1])c1[CH3]	PADEL_KR2240
PADEL_KR2241	[!#1]c1s[cH]c(c1[!#1])c2[cH][cH][cH][cH][cH]2	PADEL_KR2241
PADEL_KR2242	[!#1]c1sc([!#1])c([!#1])c1[!#1]	PADEL_KR2242
PADEL_KR2243	[!#1]c1sc([!#1])c(c1[!#1])c2[cH][cH][cH][cH][cH]2	PADEL_KR2243
PADEL_KR2244	[!#1]c1sc([CH3])c([CH3])c1[!#1]	PADEL_KR2244
PADEL_KR2245	[!#1]c1sc2[cH][cH][cH][cH]c2[n+]1[!#1]	PADEL_KR2245
PADEL_KR2246	[!#1]c1sc2[cH][cH][cH][cH]c2c1[!#1]	PADEL_KR2246
PADEL_KR2247	[!#1]c1sc2[cH][cH][cH][cH]c2c1Cl	PADEL_KR2247
PADEL_KR2248	[!#1]c1sc2[cH][cH]c([!#1])[cH]c2[n+]1[!#1]	PADEL_KR2248
PADEL_KR2249	[!#1]c1sc2[cH][cH]c3[cH][cH][cH][cH]c3c2[n+]1[!#1]	PADEL_KR2249
PADEL_KR2250	[!#1]c1sc2[cH]c([!#1])[cH][cH]c2c1[!#1]	PADEL_KR2250
PADEL_KR2251	[!#1]c1sc2[cH]c(F)[cH][cH]c2c1Cl	PADEL_KR2251
PADEL_KR2252	[!#1]c1sc2[CH2][CH2][CH2][CH2]c2c1[!#1]	PADEL_KR2252
PADEL_KR2253	[!#1]c1sc2[CH2][CH2][CH2][CH2]c2c1C(=O)[NH2]	PADEL_KR2253
PADEL_KR2254	[!#1]c1sc2c([!#1])[cH][cH][cH]c2c1[!#1]	PADEL_KR2254
PADEL_KR2255	[!#1]c1sc2c([!#1])c([!#1])[cH][cH]c2c1[!#1]	PADEL_KR2255
PADEL_KR2256	[!#1]c1sc2C(=N[OH])[CH2][CH2][CH2]c2c1[!#1]	PADEL_KR2256
PADEL_KR2257	[!#1]c1sc2C(=O)[CH2][CH2][CH2]c2c1[!#1]	PADEL_KR2257
PADEL_KR2258	[!#1]c1sc2n[cH]nc([!#1])c2c1[!#1]	PADEL_KR2258
PADEL_KR2259	[!#1]Cl	PADEL_KR2259
PADEL_KR2260	[!#1]F	PADEL_KR2260
PADEL_KR2261	[!#1]I	PADEL_KR2261
PADEL_KR2262	[!#1]N([!#1])[!#1]	PADEL_KR2262
PADEL_KR2263	[!#1]N([!#1])[CH2]c1[cH][cH][cH][cH][cH]1	PADEL_KR2263
PADEL_KR2264	[!#1]N([!#1])[CH3]	PADEL_KR2264
PADEL_KR2265	[!#1]N([!#1])C(=O)[!#1]	PADEL_KR2265
PADEL_KR2266	[!#1]N([!#1])C(=O)O[CH2][CH3]	PADEL_KR2266
PADEL_KR2267	[!#1]N([!#1])c1[cH][cH][cH][cH][cH]1	PADEL_KR2267
PADEL_KR2268	[!#1]N([!#1])c1[cH][cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR2268
PADEL_KR2269	[!#1]N([CH]([CH]([CH3])[CH3])C(=O)[!#1])C(=O)c1[cH][cH][cH][cH]c1C(=O)[!#1]	PADEL_KR2269
PADEL_KR2270	[!#1]N([CH]([CH]([CH3])[CH3])C(=O)[OH])C(=S)SC([!#1])([!#1])C(=O)[!#1]	PADEL_KR2270
PADEL_KR2271	[!#1]N([CH]([CH2]c1[cH][cH][cH][cH][cH]1)C(=O)[!#1])C(=O)c2[cH][cH][cH][cH]c2C(=O)[!#1]	PADEL_KR2271
PADEL_KR2272	[!#1]N([CH]([CH2]c1[cH][cH]c([cH][cH]1)[N+](=O)[O-])C(=O)[!#1])C(=O)c2[cH][cH][cH][cH]c2C(=O)[!#1]	PADEL_KR2272
PADEL_KR2273	[!#1]N([CH]([CH3])[CH3])[CH]([CH3])[CH3]	PADEL_KR2273
PADEL_KR2274	[!#1]N([CH]1[CH2][CH2][CH2][CH2][CH2]1)[CH]2[CH2][CH2][CH2][CH2][CH2]2	PADEL_KR2274
PADEL_KR2275	[!#1]N([CH2][CH2][CH2][CH2][CH2]C(=O)[!#1])C(=O)c1[cH][cH][cH][cH]c1C(=O)[!#1]	PADEL_KR2275
PADEL_KR2276	[!#1]N([CH2][CH2][CH2][CH3])[CH2][CH2][CH2][CH3]	PADEL_KR2276
PADEL_KR2277	[!#1]N([CH2][CH2][CH2][CH3])C(=O)[!#1]	PADEL_KR2277
PADEL_KR2278	[!#1]N([CH2][CH2][CH2]C(=O)[!#1])[CH2]C(=O)[!#1]	PADEL_KR2278
PADEL_KR2279	[!#1]N([CH2][CH2][CH2]C(=O)[!#1])C(=O)c1[cH][cH][cH][cH]c1C(=O)[!#1]	PADEL_KR2279
PADEL_KR2280	[!#1]N([CH2][CH2][CH2]C(=O)[!#1])C(=S)SC([!#1])([!#1])C(=O)[!#1]	PADEL_KR2280
PADEL_KR2281	[!#1]N([CH2][CH2][CH2]C(=O)[!#1])c1[cH][cH]c([cH][cH]1)S(=O)(=O)[!#1]	PADEL_KR2281
PADEL_KR2282	[!#1]N([CH2][CH2][CH2]S(=O)(=O)[OH])c1[cH][cH][cH][cH]c1SC([!#1])([!#1])[!#1]	PADEL_KR2282
PADEL_KR2283	[!#1]N([CH2][CH2][OH])[CH2][CH2][OH]	PADEL_KR2283
PADEL_KR2284	[!#1]N([CH2][CH2]C(=O)[!#1])C(=O)c1[cH][cH][cH][cH]c1C(=O)[!#1]	PADEL_KR2284
PADEL_KR2285	[!#1]N([CH2][CH2]C(=O)[!#1])C(=S)SC([!#1])([!#1])C(=O)[!#1]	PADEL_KR2285
PADEL_KR2286	[!#1]N([CH2][CH2]C(=O)[OH])C(=S)SC([!#1])([!#1])C(=O)[!#1]	PADEL_KR2286
PADEL_KR2287	[!#1]N([CH2][CH3])[CH2][CH2][OH]	PADEL_KR2287
PADEL_KR2288	[!#1]N([CH2][CH3])[CH2][CH3]	PADEL_KR2288
PADEL_KR2289	[!#1]N([CH2][CH3])C(=O)[!#1]	PADEL_KR2289
PADEL_KR2290	[!#1]N([CH2][CH3])c1[cH][cH][cH][cH][cH]1	PADEL_KR2290
PADEL_KR2291	[!#1]N([CH2]C([CH3])([CH3])[CH2][CH]=C([CH3])[CH3])C(=O)[CH3]	PADEL_KR2291
PADEL_KR2292	[!#1]N([CH2]C(=O)[!#1])C(=O)c1[cH][cH][cH][cH]c1C(=O)[!#1]	PADEL_KR2292
PADEL_KR2293	[!#1]N([CH2]C(=O)[!#1])C(=O)c1[cH][cH][cH]c2[cH][cH][cH]c(C(=O)[!#1])c12	PADEL_KR2293
PADEL_KR2294	[!#1]N([CH2]C(=O)[!#1])C(=O)SC([!#1])([!#1])C(=O)[!#1]	PADEL_KR2294
PADEL_KR2295	[!#1]N([CH2]C(=O)[!#1])C(=S)SC([!#1])([!#1])C(=O)[!#1]	PADEL_KR2295
PADEL_KR2296	[!#1]N([CH2]C(=O)[OH])[CH2]C(=O)[OH]	PADEL_KR2296
PADEL_KR2297	[!#1]N([CH2]C(=O)[OH])C(=S)SC([!#1])([!#1])C(=O)[!#1]	PADEL_KR2297
PADEL_KR2298	[!#1]N([CH2]c1[cH][cH][cH][cH][cH]1)[CH2]c2[cH][cH][cH][cH][cH]2	PADEL_KR2298
PADEL_KR2299	[!#1]N([CH2]c1[cH][cH][cH][cH][cH]1)C([CH3])([CH3])[CH3]	PADEL_KR2299
PADEL_KR2300	[!#1]N([CH2]c1[cH][cH][cH][cH][cH]1)C(=S)SC([!#1])([!#1])C(=O)[!#1]	PADEL_KR2300
PADEL_KR2301	[!#1]N([CH2]c1[cH][cH]c(Cl)[cH]c1Cl)c2[cH][cH][cH]c(Cl)[cH]2	PADEL_KR2301
PADEL_KR2302	[!#1]N([CH2]c1[cH][cH]c(F)[cH][cH]1)c2[cH][cH]c(I)[cH][cH]2	PADEL_KR2302
PADEL_KR2303	[!#1]N([CH3])[CH2][CH2][OH]	PADEL_KR2303
PADEL_KR2304	[!#1]N([CH3])[CH2]C(=O)[OH]	PADEL_KR2304
PADEL_KR2305	[!#1]N([CH3])[CH2]c1[cH][cH][cH][cH][cH]1	PADEL_KR2305
PADEL_KR2306	[!#1]N([CH3])[CH3]	PADEL_KR2306
PADEL_KR2307	[!#1]N([CH3])C(=[NH])[NH]C(=[NH])[NH2]	PADEL_KR2307
PADEL_KR2308	[!#1]N([CH3])C(=O)[!#1]	PADEL_KR2308
PADEL_KR2309	[!#1]N([CH3])C(=O)[CH3]	PADEL_KR2309
PADEL_KR2310	[!#1]N([CH3])c1[cH][cH][cH][cH][cH]1	PADEL_KR2310
PADEL_KR2311	[!#1]N([CH3])c1[cH][cH][cH][cH]c1C([!#1])([!#1])C(=O)[!#1]	PADEL_KR2311
PADEL_KR2312	[!#1]N([CH3])c1[cH][cH]c([!#1])[cH][cH]1	PADEL_KR2312
PADEL_KR2313	[!#1]N([CH3])c1[cH]c([!#1])c2[cH][cH][cH][cH]c2n1	PADEL_KR2313
PADEL_KR2314	[!#1]N([CH3])S(=O)(=O)[!#1]	PADEL_KR2314
PADEL_KR2315	[!#1]N(C(=O)[!#1])S(=O)(=O)[!#1]	PADEL_KR2315
PADEL_KR2316	[!#1]N(C(=O)[CH]([CH2]C(=O)[!#1])S[CH2]C(=O)[!#1])c1[cH][cH][cH]c(Cl)[cH]1	PADEL_KR2316
PADEL_KR2317	[!#1]N(C(=O)[CH2][CH2][CH3])S(=O)(=O)[!#1]	PADEL_KR2317
PADEL_KR2318	[!#1]N(C(=O)[CH3])C(=O)[CH3]	PADEL_KR2318
PADEL_KR2319	[!#1]N(C(=O)c1[cH]c([cH][cH]c1C(=O)[!#1])C(=O)[!#1])c2[cH][cH]c([cH][cH]2)C(=O)[!#1]	PADEL_KR2319
PADEL_KR2320	[!#1]N(C(=O)c1[cH]c([cH][cH]c1C(=O)[!#1])C(=O)[OH])c2[cH][cH]c([!#1])[cH][cH]2	PADEL_KR2320
PADEL_KR2321	[!#1]N(C(=S)SC([!#1])([!#1])C(=O)[!#1])c1[cH][cH]c([cH][cH]1)C(=O)[OH]	PADEL_KR2321
PADEL_KR2322	[!#1]N(c1[cH][cH][cH][cH][cH]1)c2[cH][cH][cH][cH][cH]2	PADEL_KR2322
PADEL_KR2323	[!#1]N=[CH][CH]([!#1])[!#1]	PADEL_KR2323
PADEL_KR2324	[!#1]N=[CH][CH]=N[!#1]	PADEL_KR2324
PADEL_KR2325	[!#1]N=[CH]c1[cH][cH][cH][cH][cH]1	PADEL_KR2325
PADEL_KR2326	[!#1]N=[CH]c1[cH][cH][cH][cH]c1[N+](=O)[O-]	PADEL_KR2326
PADEL_KR2327	[!#1]N=[CH]c1[cH][cH][cH][cH]c1[OH]	PADEL_KR2327
PADEL_KR2328	[!#1]N=[CH]c1[cH][cH][cH][cH]c1F	PADEL_KR2328
PADEL_KR2329	[!#1]N=[CH]c1[cH][cH][cH][nH]1	PADEL_KR2329
PADEL_KR2330	[!#1]N=[CH]c1[cH][cH][cH]c([cH]1)[N+](=O)[O-]	PADEL_KR2330
PADEL_KR2331	[!#1]N=[CH]c1[cH][cH][cH]c([OH])[cH]1	PADEL_KR2331
PADEL_KR2332	[!#1]N=[CH]c1[cH][cH][cH]c(Cl)[cH]1	PADEL_KR2332
PADEL_KR2333	[!#1]N=[CH]c1[cH][cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR2333
PADEL_KR2334	[!#1]N=[CH]c1[cH][cH][cH]n[cH]1	PADEL_KR2334
PADEL_KR2335	[!#1]N=[CH]c1[cH][cH][cH]o1	PADEL_KR2335
PADEL_KR2336	[!#1]N=[CH]c1[cH][cH]c([!#1])[cH][cH]1	PADEL_KR2336
PADEL_KR2337	[!#1]N=[CH]c1[cH][cH]c([!#1])o1	PADEL_KR2337
PADEL_KR2338	[!#1]N=[CH]c1[cH][cH]c([cH][cH]1)[N+](=O)[O-]	PADEL_KR2338
PADEL_KR2339	[!#1]N=[CH]c1[cH][cH]c([cH][cH]1)N([!#1])[CH2][CH3]	PADEL_KR2339
PADEL_KR2340	[!#1]N=[CH]c1[cH][cH]c([cH][cH]1)N([!#1])[CH3]	PADEL_KR2340
PADEL_KR2341	[!#1]N=[CH]c1[cH][cH]c([CH]=N[!#1])[cH][cH]1	PADEL_KR2341
PADEL_KR2342	[!#1]N=[CH]c1[cH][cH]c([CH3])o1	PADEL_KR2342
PADEL_KR2343	[!#1]N=[CH]c1[cH][cH]c([OH])[cH][cH]1	PADEL_KR2343
PADEL_KR2344	[!#1]N=[CH]c1[cH][cH]c([OH])[cH]c1[OH]	PADEL_KR2344
PADEL_KR2345	[!#1]N=[CH]c1[cH][cH]c([OH])c([OH])[cH]1	PADEL_KR2345
PADEL_KR2346	[!#1]N=[CH]c1[cH][cH]c(Br)[cH][cH]1	PADEL_KR2346
PADEL_KR2347	[!#1]N=[CH]c1[cH][cH]c(Br)s1	PADEL_KR2347
PADEL_KR2348	[!#1]N=[CH]c1[cH][cH]c(C#Cc2[cH][cH][cH][cH][cH]2)[cH][cH]1	PADEL_KR2348
PADEL_KR2349	[!#1]N=[CH]c1[cH][cH]c(Cl)[cH][cH]1	PADEL_KR2349
PADEL_KR2350	[!#1]N=[CH]c1[cH][cH]c(Cl)[cH]c1Cl	PADEL_KR2350
PADEL_KR2351	[!#1]N=[CH]c1[cH][cH]c(s1)[N+](=O)[O-]	PADEL_KR2351
PADEL_KR2352	[!#1]N=[CH]c1[cH][cH]c2n([!#1])c3[cH][cH][cH][cH]c3c2[cH]1	PADEL_KR2352
PADEL_KR2353	[!#1]N=[CH]c1[cH][cH]c2O[CH2]Oc2[cH]1	PADEL_KR2353
PADEL_KR2354	[!#1]N=[CH]c1[cH][nH]c2[cH][cH][cH][cH]c12	PADEL_KR2354
PADEL_KR2355	[!#1]N=[CH]c1[cH]c([cH][cH]c1[OH])[N+](=O)[O-]	PADEL_KR2355
PADEL_KR2356	[!#1]N=[CH]c1[cH]c(Br)[cH][cH]c1[OH]	PADEL_KR2356
PADEL_KR2357	[!#1]N=[CH]c1[cH]c(Br)[cH]c(c1[OH])C([CH3])([CH3])[CH3]	PADEL_KR2357
PADEL_KR2358	[!#1]N=[CH]c1[cH]c(c([OH])c([cH]1)C([CH3])([CH3])[CH3])C([CH3])([CH3])[CH3]	PADEL_KR2358
PADEL_KR2359	[!#1]N=[CH]c1[cH]c(Cl)[cH]c(Cl)c1[OH]	PADEL_KR2359
PADEL_KR2360	[!#1]N=[CH]c1[cH]c2O[CH2]Oc2[cH]c1[N+](=O)[O-]	PADEL_KR2360
PADEL_KR2361	[!#1]N=[CH]c1c([CH3])[nH]n([!#1])c1=O	PADEL_KR2361
PADEL_KR2362	[!#1]N=[CH]c1c([OH])[cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR2362
PADEL_KR2363	[!#1]N=[CH]c1c2[cH][cH][cH][cH]c2[cH]c3[cH][cH][cH][cH]c13	PADEL_KR2363
PADEL_KR2364	[!#1]N=[CH]c1s[cH][cH]c1[CH3]	PADEL_KR2364
PADEL_KR2365	[!#1]N=[CH]N([CH3])[CH3]	PADEL_KR2365
PADEL_KR2366	[!#1]N=[N+]([!#1])[O-]	PADEL_KR2366
PADEL_KR2367	[!#1]N=[N+]=[N-]	PADEL_KR2367
PADEL_KR2368	[!#1]N=C([CH]([!#1])[!#1])[CH]([!#1])[!#1]	PADEL_KR2368
PADEL_KR2369	[!#1]N=C([CH3])N([CH3])[CH3]	PADEL_KR2369
PADEL_KR2370	[!#1]N=C(O[CH3])c1[cH][cH]c([CH3])[cH][cH]1	PADEL_KR2370
PADEL_KR2371	[!#1]N=C(OC(=O)C([!#1])([!#1])[!#1])c1[cH][cH][cH][cH][cH]1	PADEL_KR2371
PADEL_KR2372	[!#1]N=C1[CH](C(=O)c2[cH][cH][cH][cH]c12)c3[cH][cH][cH][cH][cH]3	PADEL_KR2372
PADEL_KR2373	[!#1]N=c1[cH][cH]n([!#1])[cH][cH]1	PADEL_KR2373
PADEL_KR2374	[!#1]N=C1[CH2][CH2][CH2]c2[cH][cH][cH][cH]c2[NH]1	PADEL_KR2374
PADEL_KR2375	[!#1]N=C1[NH]C(=[NH])c2[cH][cH][cH][cH]c12	PADEL_KR2375
PADEL_KR2376	[!#1]N=C1C(=O)[NH]c2[cH][cH][cH][cH]c12	PADEL_KR2376
PADEL_KR2377	[!#1]N=c1s[cH]c([!#1])n1[!#1]	PADEL_KR2377
PADEL_KR2378	[!#1]N=c1s[cH]c(c2[cH][cH]c([!#1])[cH][cH]2)n1[!#1]	PADEL_KR2378
PADEL_KR2379	[!#1]N=N[!#1]	PADEL_KR2379
PADEL_KR2380	[!#1]N=O	PADEL_KR2380
PADEL_KR2381	[!#1]N1[CH]([CH3])[CH2][CH2][CH2][CH]1[CH3]	PADEL_KR2381
PADEL_KR2382	[!#1]N1[CH](S[CH2]C1=O)c2[cH][cH][cH][cH][cH]2	PADEL_KR2382
PADEL_KR2383	[!#1]n1[cH][cH][cH][cH]c1=[NH]	PADEL_KR2383
PADEL_KR2384	[!#1]n1[cH][cH][cH]c([CH3])c1=[NH]	PADEL_KR2384
PADEL_KR2385	[!#1]n1[cH][cH][cH]c1[CH]=O	PADEL_KR2385
PADEL_KR2386	[!#1]n1[cH][cH][cH]n1	PADEL_KR2386
PADEL_KR2387	[!#1]n1[cH][cH][cH]nc1=[NH]	PADEL_KR2387
PADEL_KR2388	[!#1]n1[cH][cH]c([CH3])n1	PADEL_KR2388
PADEL_KR2389	[!#1]n1[cH][cH]c(=[NH])[cH][cH]1	PADEL_KR2389
PADEL_KR2390	[!#1]n1[cH][cH]c(=N[CH2]c2[cH][cH][cH][cH][cH]2)[cH][cH]1	PADEL_KR2390
PADEL_KR2391	[!#1]n1[cH][cH]c(=O)[nH]c1=O	PADEL_KR2391
PADEL_KR2392	[!#1]n1[cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR2392
PADEL_KR2393	[!#1]n1[cH][cH]n[cH]1	PADEL_KR2393
PADEL_KR2394	[!#1]n1[cH][cH]nc1[CH3]	PADEL_KR2394
PADEL_KR2395	[!#1]n1[cH][cH]nc1[N+](=O)[O-]	PADEL_KR2395
PADEL_KR2396	[!#1]n1[cH][cH]sc1=[NH]	PADEL_KR2396
PADEL_KR2397	[!#1]n1[cH]c(Br)[cH][cH]c1=[NH]	PADEL_KR2397
PADEL_KR2398	[!#1]n1[cH]n[cH]n1	PADEL_KR2398
PADEL_KR2399	[!#1]n1[cH]n[n+]([!#1])[cH]1	PADEL_KR2399
PADEL_KR2400	[!#1]n1[cH]nc([cH]1)[N+](=O)[O-]	PADEL_KR2400
PADEL_KR2401	[!#1]n1[cH]nc(=O)[cH]n1	PADEL_KR2401
PADEL_KR2402	[!#1]n1[cH]nc2[cH][cH][cH][cH]c12	PADEL_KR2402
PADEL_KR2403	[!#1]n1[cH]nn[cH]1	PADEL_KR2403
PADEL_KR2404	[!#1]N1[CH2][CH]([CH2]C1=O)c2[cH][cH][cH][cH][cH]2	PADEL_KR2404
PADEL_KR2405	[!#1]N1[CH2][CH]([CH3])C([OH])([CH2][CH]1[CH3])c2[cH][cH][cH][cH][cH]2	PADEL_KR2405
PADEL_KR2406	[!#1]N1[CH2][CH2][CH]([CH2]1)c2[cH][cH][cH][cH][cH]2	PADEL_KR2406
PADEL_KR2407	[!#1]N1[CH2][CH2][CH]([CH2]c2[cH][cH][cH][cH][cH]2)[CH2][CH2]1	PADEL_KR2407
PADEL_KR2408	[!#1]N1[CH2][CH2][CH]([CH3])[CH2][CH2]1	PADEL_KR2408
PADEL_KR2409	[!#1]N1[CH2][CH2][CH]=[CH][CH2]1	PADEL_KR2409
PADEL_KR2410	[!#1]N1[CH2][CH2][CH2][CH]1C(=O)[OH]	PADEL_KR2410
PADEL_KR2411	[!#1]N1[CH2][CH2][CH2][CH2][CH]1[CH2][CH3]	PADEL_KR2411
PADEL_KR2412	[!#1]N1[CH2][CH2][CH2][CH2][CH2][CH2]1	PADEL_KR2412
PADEL_KR2413	[!#1]N1[CH2][CH2][CH2][CH2][CH2]1	PADEL_KR2413
PADEL_KR2414	[!#1]N1[CH2][CH2][CH2][CH2]1	PADEL_KR2414
PADEL_KR2415	[!#1]N1[CH2][CH2][CH2]C1=O	PADEL_KR2415
PADEL_KR2416	[!#1]N1[CH2][CH2][CH2]c2[cH][cH][cH][cH]c12	PADEL_KR2416
PADEL_KR2417	[!#1]N1[CH2][CH2][CH2]c2c([!#1])c3[cH][cH][cH][cH]c3nc12	PADEL_KR2417
PADEL_KR2418	[!#1]N1[CH2][CH2][CH2]N([!#1])[CH2][CH2]1	PADEL_KR2418
PADEL_KR2419	[!#1]N1[CH2][CH2][NH][CH2][CH2]1	PADEL_KR2419
PADEL_KR2420	[!#1]N1[CH2][CH2]C(=[CH][CH2]1)[!#1]	PADEL_KR2420
PADEL_KR2421	[!#1]N1[CH2][CH2]C(=O)[CH2][CH2]1	PADEL_KR2421
PADEL_KR2422	[!#1]N1[CH2][CH2]C2([CH2][CH2]1)O[CH2][CH2]O2	PADEL_KR2422
PADEL_KR2423	[!#1]N1[CH2][CH2]c2[cH][cH][cH][cH]c12	PADEL_KR2423
PADEL_KR2424	[!#1]N1[CH2][CH2]c2c([CH2]1)c3[cH][cH][cH][cH]c3n2[!#1]	PADEL_KR2424
PADEL_KR2425	[!#1]N1[CH2][CH2]c2c1nc3[cH][cH][cH][cH]c3c2[!#1]	PADEL_KR2425
PADEL_KR2426	[!#1]N1[CH2][CH2]c2c1nc3[cH][cH]c([!#1])[cH]c3c2[!#1]	PADEL_KR2426
PADEL_KR2427	[!#1]N1[CH2][CH2]N([!#1])[CH]1c2[cH][cH]c([!#1])[cH][cH]2	PADEL_KR2427
PADEL_KR2428	[!#1]N1[CH2][CH2]N([!#1])[CH2][CH2]1	PADEL_KR2428
PADEL_KR2429	[!#1]N1[CH2][CH2]N([CH2][CH]=[CH]c2[cH][cH][cH][cH][cH]2)[CH2][CH2]1	PADEL_KR2429
PADEL_KR2430	[!#1]N1[CH2][CH2]N([CH2][CH2]1)[CH]2[CH2]C(=O)N(C2=O)c3[cH][cH][cH][cH][cH]3	PADEL_KR2430
PADEL_KR2431	[!#1]N1[CH2][CH2]N([CH2][CH2]1)[CH]2[CH2]C(=O)N(C2=O)c3[cH][cH][cH]c([!#1])[cH]3	PADEL_KR2431
PADEL_KR2432	[!#1]N1[CH2][CH2]N([CH2][CH2]1)[CH]2[CH2]C(=O)N(C2=O)c3[cH][cH]c([!#1])[cH][cH]3	PADEL_KR2432
PADEL_KR2433	[!#1]N1[CH2][CH2]N([CH2][CH2]1)C(=O)[!#1]	PADEL_KR2433
PADEL_KR2434	[!#1]N1[CH2][CH2]N([CH2][CH2]1)c2[cH][cH][cH][cH][cH]2	PADEL_KR2434
PADEL_KR2435	[!#1]N1[CH2][CH2]N([CH2][CH2]1)c2[cH][cH][cH][cH]c2[!#1]	PADEL_KR2435
PADEL_KR2436	[!#1]N1[CH2][CH2]N([CH2][CH2]1)c2[cH][cH][cH][cH]c2O[CH3]	PADEL_KR2436
PADEL_KR2437	[!#1]N1[CH2][CH2]N([CH2][CH2]1)c2[cH][cH][cH][cH]n2	PADEL_KR2437
PADEL_KR2438	[!#1]N1[CH2][CH2]N([CH2][CH2]1)c2[cH][cH]c([!#1])[cH][cH]2	PADEL_KR2438
PADEL_KR2439	[!#1]N1[CH2][CH2]N([CH2][CH2]1)c2[cH][cH]c([cH][cH]2)[N+](=O)[O-]	PADEL_KR2439
PADEL_KR2440	[!#1]N1[CH2][CH2]N([CH2][CH2]1)c2[cH][cH]c(Cl)[cH][cH]2	PADEL_KR2440
PADEL_KR2441	[!#1]N1[CH2][CH2]N([CH2][CH2]1)c2[cH][cH]c(F)[cH][cH]2	PADEL_KR2441
PADEL_KR2442	[!#1]N1[CH2][CH2]N([CH2][CH2]1)c2[cH][cH]c3[cH][cH][cH][cH]c3n2	PADEL_KR2442
PADEL_KR2443	[!#1]N1[CH2][CH2]N([CH2][CH2]1)S(=O)(=O)[!#1]	PADEL_KR2443
PADEL_KR2444	[!#1]N1[CH2][CH2]N([CH3])[CH2][CH2]1	PADEL_KR2444
PADEL_KR2445	[!#1]N1[CH2][CH2]N2[CH2][CH2][CH2][CH]2[CH2]1	PADEL_KR2445
PADEL_KR2446	[!#1]N1[CH2][CH2]n2c3[CH]1[CH2][CH2][CH2]c3c4[cH]c([!#1])[cH][cH]c24	PADEL_KR2446
PADEL_KR2447	[!#1]N1[CH2][CH2]n2c3[CH]1[CH2][CH2][CH2]c3c4[cH]c([CH3])[cH][cH]c24	PADEL_KR2447
PADEL_KR2448	[!#1]N1[CH2][CH2]O[CH2][CH2]1	PADEL_KR2448
PADEL_KR2449	[!#1]N1[CH2][CH2]O[CH2][CH2]O[CH2][CH2][NH][CH2][CH2]O[CH2][CH2]O[CH2][CH2]1	PADEL_KR2449
PADEL_KR2450	[!#1]N1[CH2][CH2]O[CH2][CH2]O[CH2][CH2]N([!#1])[CH2][CH2]O[CH2][CH2]O[CH2][CH2]1	PADEL_KR2450
PADEL_KR2451	[!#1]N1[CH2][CH2]O[CH2][CH2]O[CH2][CH2]O[CH2][CH2]O[CH2][CH2]1	PADEL_KR2451
PADEL_KR2452	[!#1]N1[CH2][CH2]O[CH2][CH2]O[CH2][CH2]O[CH2][CH2]O[CH2][CH2]O[CH2][CH2]1	PADEL_KR2452
PADEL_KR2453	[!#1]N1[CH2][CH2]SC1=[NH]	PADEL_KR2453
PADEL_KR2454	[!#1]N1[CH2]C([!#1])([!#1])C(=O)C([!#1])([!#1])[CH2]1	PADEL_KR2454
PADEL_KR2455	[!#1]N1[CH2]C(=O)[NH]c2[cH][cH][cH][cH]c12	PADEL_KR2455
PADEL_KR2456	[!#1]N1[CH2]C(=O)N([!#1])C(=O)[CH2]1	PADEL_KR2456
PADEL_KR2457	[!#1]N1[CH2]c2[cH][cH][cH][cH]c2[CH2]1	PADEL_KR2457
PADEL_KR2458	[!#1]N1[CH2]c2[cH][cH][cH][cH]c2C1=O	PADEL_KR2458
PADEL_KR2459	[!#1]n1c([CH3])[cH][cH]c1[CH3]	PADEL_KR2459
PADEL_KR2460	[!#1]n1c([CH3])[cH]c([CH3])nc1=O	PADEL_KR2460
PADEL_KR2461	[!#1]n1c([CH3])n[cH]c1[N+](=O)[O-]	PADEL_KR2461
PADEL_KR2462	[!#1]n1c([CH3])nc2[cH][cH][cH][cH]c12	PADEL_KR2462
PADEL_KR2463	[!#1]n1c(=[NH])n([!#1])c2[cH][cH][cH][cH]c12	PADEL_KR2463
PADEL_KR2464	[!#1]n1c(=[NH])sc2[cH][cH][cH][cH]c12	PADEL_KR2464
PADEL_KR2465	[!#1]N1C(=O)[CH]=[CH]C1=O	PADEL_KR2465
PADEL_KR2466	[!#1]N1C(=O)[CH]2[CH]([CH]3[CH]=[CH][CH]2[CH]4[CH]3C(=O)N([!#1])C4=O)C1=O	PADEL_KR2466
PADEL_KR2467	[!#1]N1C(=O)[CH]2[CH]([CH]3[CH]=[CH][CH]2[CH]4[CH2][CH]43)C1=O	PADEL_KR2467
PADEL_KR2468	[!#1]N1C(=O)[CH]2[CH]([CH]3c4[cH][cH][cH][cH]c4[CH]2c5[cH][cH][cH][cH]c35)C1=O	PADEL_KR2468
PADEL_KR2469	[!#1]N1C(=O)[CH]2[CH]3[CH2][CH]([CH]=[CH]3)[CH]2C1=O	PADEL_KR2469
PADEL_KR2470	[!#1]N1C(=O)[CH]2[CH]3OC([!#1])([CH]=[CH]3)[CH]2C1=O	PADEL_KR2470
PADEL_KR2471	[!#1]N1C(=O)[CH2][CH2]C1=O	PADEL_KR2471
PADEL_KR2472	[!#1]N1C(=O)[CH2][NH][CH2]C1=O	PADEL_KR2472
PADEL_KR2473	[!#1]N1C(=O)[CH2]SC1=S	PADEL_KR2473
PADEL_KR2474	[!#1]N1C(=O)[NH]C2([CH2][CH2][CH2][CH2][CH2]2)C1=O	PADEL_KR2474
PADEL_KR2475	[!#1]N1C(=O)[NH]C2([CH2][CH2][CH2][CH2]2)C1=O	PADEL_KR2475
PADEL_KR2476	[!#1]N1C(=O)C([!#1])([OH])c2[cH][cH][cH][cH]c12	PADEL_KR2476
PADEL_KR2477	[!#1]N1C(=O)C(=[CH]c2[cH][cH][cH][cH][cH]2)SC1=S	PADEL_KR2477
PADEL_KR2478	[!#1]N1C(=O)C(=[CH]c2[cH][cH]c(Cl)[cH][cH]2)SC1=S	PADEL_KR2478
PADEL_KR2479	[!#1]N1C(=O)C(=[CH]c2[cH][cH]c(F)[cH][cH]2)SC1=S	PADEL_KR2479
PADEL_KR2480	[!#1]N1C(=O)C(=[CH]c2[cH][cH]c(O[CH3])[cH][cH]2)SC1=S	PADEL_KR2480
PADEL_KR2481	[!#1]N1C(=O)C(=C2C(=O)[NH]c3[cH][cH][cH][cH]c23)SC1=S	PADEL_KR2481
PADEL_KR2482	[!#1]N1C(=O)C(=C2SC(=S)N([!#1])C2=O)SC1=S	PADEL_KR2482
PADEL_KR2483	[!#1]N1C(=O)C(=C2S(c3[cH][cH][cH][cH]c3N2[!#1])SC1=S)	PADEL_KR2483
PADEL_KR2484	[!#1]N1C(=O)C(=O)c2[cH][cH][cH][cH]c12	PADEL_KR2484
PADEL_KR2485	[!#1]N1C(=O)C(=O)c2[cH]c([!#1])[cH][cH]c12	PADEL_KR2485
PADEL_KR2486	[!#1]N1C(=O)c2[cH][cH][cH][cH]c2C1=O	PADEL_KR2486
PADEL_KR2487	[!#1]N1C(=O)c2[cH][cH][cH]c3[cH][cH][cH]c(C1=O)c23	PADEL_KR2487
PADEL_KR2488	[!#1]N1C(=O)c2[cH][cH][cH]c3c([!#1])[cH][cH]c(C1=O)c23	PADEL_KR2488
PADEL_KR2489	[!#1]N1C(=O)c2[cH][cH][cH]c3c([!#1])[cH][cH]c1c23	PADEL_KR2489
PADEL_KR2490	[!#1]N1C(=O)c2[cH][cH][cH]c3c([cH][cH]c(C1=O)c23)N4[CH2][CH2]O[CH2][CH2]4	PADEL_KR2490
PADEL_KR2491	[!#1]N1C(=O)c2[cH][cH]c([!#1])[cH]c2C1=O	PADEL_KR2491
PADEL_KR2492	[!#1]N1C(=O)c2[cH][cH]c([cH]c2C1=O)[N+](=O)[O-]	PADEL_KR2492
PADEL_KR2493	[!#1]N1C(=O)c2[cH][cH]c([cH]c2C1=O)C(=O)[OH]	PADEL_KR2493
PADEL_KR2494	[!#1]N1C(=O)c2[cH][cH]c([cH]c2C1=O)c3[cH][cH]c4C(=O)N([!#1])C(=O)c4[cH]3	PADEL_KR2494
PADEL_KR2495	[!#1]N1C(=O)c2[cH][cH]c(Br)[cH]c2C1=O	PADEL_KR2495
PADEL_KR2496	[!#1]n1c(=O)c2[cH]c3c(=O)n([!#1])c(=O)c3[cH]c2c1=O	PADEL_KR2496
PADEL_KR2497	[!#1]N1C(=O)N([!#1])C(=O)C([!#1])([!#1])C1=O	PADEL_KR2497
PADEL_KR2498	[!#1]n1c(=O)n([!#1])c(=O)n([!#1])c1=O	PADEL_KR2498
PADEL_KR2499	[!#1]n1c(=O)oc2[cH][cH][cH][cH]c12	PADEL_KR2499
PADEL_KR2500	[!#1]n1c(=O)oc2[cH]c(Br)[cH][cH]c12	PADEL_KR2500
PADEL_KR2501	[!#1]n1c(=O)oc2[cH]c(Cl)[cH][cH]c12	PADEL_KR2501
PADEL_KR2502	[!#1]n1c(=S)n([!#1])c2[cH][cH][cH][cH]c12	PADEL_KR2502
PADEL_KR2503	[!#1]n1c(=S)oc2[cH][cH][cH][cH]c12	PADEL_KR2503
PADEL_KR2504	[!#1]n1c(=S)sc2[cH][cH][cH][cH]c12	PADEL_KR2504
PADEL_KR2505	[!#1]N1c2[cH][cH][cH][cH]c2[CH]=[CH]c3[cH][cH][cH][cH]c13	PADEL_KR2505
PADEL_KR2506	[!#1]N1c2[cH][cH][cH][cH]c2[CH]=[CH]c3[cH][cH]c([!#1])[cH]c13	PADEL_KR2506
PADEL_KR2507	[!#1]N1c2[cH][cH][cH][cH]c2[CH2][CH2]c3[cH][cH][cH][cH]c13	PADEL_KR2507
PADEL_KR2508	[!#1]N1c2[cH][cH][cH][cH]c2[CH2][CH2]c3[cH][cH]c([!#1])[cH]c13	PADEL_KR2508
PADEL_KR2509	[!#1]N1c2[cH][cH][cH][cH]c2[CH2][CH2]c3[cH][cH]c([NH]C(=O)[!#1])[cH]c13	PADEL_KR2509
PADEL_KR2510	[!#1]N1c2[cH][cH][cH][cH]c2C([CH3])([CH3])C1([!#1])[!#1]	PADEL_KR2510
PADEL_KR2511	[!#1]n1c2[cH][cH][cH][cH]c2c(=O)c3[cH][cH][cH][cH]c13	PADEL_KR2511
PADEL_KR2512	[!#1]n1c2[cH][cH][cH][cH]c2c3[cH][cH][cH][cH]c13	PADEL_KR2512
PADEL_KR2513	[!#1]n1c2[cH][cH][cH][cH]c2c3nc4[cH][cH]c([cH]c4[cH]c13)[N+](=O)[O-]	PADEL_KR2513
PADEL_KR2514	[!#1]N1c2[cH][cH][cH][cH]c2Oc3nnc(Cl)[cH]c13	PADEL_KR2514
PADEL_KR2515	[!#1]N1c2[cH][cH][cH][cH]c2SC1([!#1])[!#1]	PADEL_KR2515
PADEL_KR2516	[!#1]N1c2[cH][cH][cH][cH]c2S(c3[cH][cH][cH][cH]c13)	PADEL_KR2516
PADEL_KR2517	[!#1]N1c2[cH][cH][cH][cH]c2S(c3[cH][cH]c([!#1])[cH]c13)	PADEL_KR2517
PADEL_KR2518	[!#1]N1c2[cH][cH][cH][cH]c2S(c3[cH][cH]c([cH]c13)C(F)(F)F)	PADEL_KR2518
PADEL_KR2519	[!#1]N1c2[cH][cH][cH][cH]c2S(c3[cH][cH]c([NH]C(=O)[!#1])[cH]c13)	PADEL_KR2519
PADEL_KR2520	[!#1]n1c2[cH][cH]c(Br)[cH]c2c3[cH]c(Br)[cH][cH]c13	PADEL_KR2520
PADEL_KR2521	[!#1]n1c2[cH][cH]c(Cl)[cH]c2c3[cH]c(Cl)[cH][cH]c13	PADEL_KR2521
PADEL_KR2522	[!#1]n1c2[CH2][CH2][CH2][CH2]c2sc1=[NH]	PADEL_KR2522
PADEL_KR2523	[!#1]n1c2[CH2][CH2][CH2]c2c(=[NH])c3[cH][cH][cH][cH]c13	PADEL_KR2523
PADEL_KR2524	[!#1]n1c2[CH2][CH2][CH2]c2c3[cH][cH][cH][cH]c13	PADEL_KR2524
PADEL_KR2525	[!#1]n1c-2c([CH2][CH2]c3c2[cH]nn3c4[cH][cH][cH][cH][cH]4)c5[cH][cH][cH][cH]c15	PADEL_KR2525
PADEL_KR2526	[!#1]n1c2C(=O)[CH2][CH2][CH2]c2c3[cH]c([CH3])[cH][cH]c13	PADEL_KR2526
PADEL_KR2527	[!#1]n1c2c(n([!#1])c3[cH][cH][cH][cH]c23)c4[cH][cH][cH][cH]c14	PADEL_KR2527
PADEL_KR2528	[!#1]n1n[cH][n+]2nc([CH3])[cH]c([OH])c12	PADEL_KR2528
PADEL_KR2529	[!#1]N1N=C([CH2][CH](C1=O)c2[cH][nH]c3[cH][cH][cH][cH]c23)c4[cH][cH][cH][cH][cH]4	PADEL_KR2529
PADEL_KR2530	[!#1]N1N=C([CH2][CH](C1=O)c2[cH]n([!#1])c3[cH][cH][cH][cH]c23)c4[cH][cH][cH][cH][cH]4	PADEL_KR2530
PADEL_KR2531	[!#1]N1N=C2[CH]([CH2][CH2]c3[cH][cH]c([!#1])[cH]c23)[CH]1c4[cH][cH]c([!#1])[cH][cH]4	PADEL_KR2531
PADEL_KR2532	[!#1]N1N=C2[CH]([CH2][CH2]c3[cH]c([!#1])[cH][cH]c23)[CH]1c4[cH][cH]c([!#1])[cH][cH]4	PADEL_KR2532
PADEL_KR2533	[!#1]n1nc([CH3])[cH]c1[CH3]	PADEL_KR2533
PADEL_KR2534	[!#1]n1nc([CH3])c(Br)c1[CH3]	PADEL_KR2534
PADEL_KR2535	[!#1]n1nc(c2[cH][cH][cH][cH][cH]2)c3[cH][cH][cH]c3c1c4[cH][cH][cH][cH][cH]4	PADEL_KR2535
PADEL_KR2536	[!#1]n1nc(nc1c2[cH][cH][cH][cH][cH]2)c3[cH][cH][cH][cH][cH]3	PADEL_KR2536
PADEL_KR2537	[!#1]n1nc2[cH][cH][cH][cH]c2n1	PADEL_KR2537
PADEL_KR2538	[!#1]n1nc2C(=N[NH][CH3])c3nn([!#1])nc3C(=N[NH][CH3])c2n1	PADEL_KR2538
PADEL_KR2539	[!#1]n1nc2C(=N[OH])c3nn([!#1])nc3C(=N[OH])c2n1	PADEL_KR2539
PADEL_KR2540	[!#1]n1nc2C(=NN=C([CH3])[CH3])c3nn([!#1])nc3C(=NN=C([CH3])[CH3])c2n1	PADEL_KR2540
PADEL_KR2541	[!#1]n1nc2C(=NOC(=O)[CH3])c3nn([!#1])nc3C(=NOC(=O)[CH3])c2n1	PADEL_KR2541
PADEL_KR2542	[!#1]n1nnc2[cH][cH][cH][cH]c12	PADEL_KR2542
PADEL_KR2543	[!#1]n1nnc2c(=O)oc3[cH][cH][cH][cH]c3c12	PADEL_KR2543
PADEL_KR2544	[!#1]n1nnnc1C2([!#1])[CH2][CH2][CH2][CH2][CH2]2	PADEL_KR2544
PADEL_KR2545	[!#1]n1nnnc1C2([!#1])[CH2][CH2][CH2][CH2]2	PADEL_KR2545
PADEL_KR2546	[!#1]n1nnnc1c2[cH][cH][cH][cH][cH]2	PADEL_KR2546
PADEL_KR2547	[!#1]O[!#1]	PADEL_KR2547
PADEL_KR2548	[!#1]O[CH]([!#1])[!#1]	PADEL_KR2548
PADEL_KR2549	[!#1]O[CH]([CH]([!#1])[CH2][CH]1[CH2][CH2]N([!#1])[CH2][CH]1[CH]([!#1])[!#1])c2[cH][cH]nc3[cH][cH][cH][cH]c23	PADEL_KR2549
PADEL_KR2550	[!#1]O[CH]([CH3])[CH3]	PADEL_KR2550
PADEL_KR2551	[!#1]O[CH]([CH3])C([!#1])([!#1])Cl	PADEL_KR2551
PADEL_KR2552	[!#1]O[CH]([CH3])C(=O)[NH][NH2]	PADEL_KR2552
PADEL_KR2553	[!#1]O[CH]([CH3])C(=O)[NH]N=[CH][!#1]	PADEL_KR2553
PADEL_KR2554	[!#1]O[CH]([CH3])C(=O)[NH]N=[CH]c1[cH][cH][cH][cH][cH]1	PADEL_KR2554
PADEL_KR2555	[!#1]O[CH]([CH3])C(=O)[NH]N=[CH]c1[cH][cH][cH]c([cH]1)[N+](=O)[O-]	PADEL_KR2555
PADEL_KR2556	[!#1]O[CH]([CH3])C(=O)[NH]N=[CH]c1[cH]c([cH][cH]c1[OH])[N+](=O)[O-]	PADEL_KR2556
PADEL_KR2557	[!#1]O[CH]([CH3])C(=O)[OH]	PADEL_KR2557
PADEL_KR2558	[!#1]O[CH]([NH]C(=O)[!#1])C(Br)(Br)Br	PADEL_KR2558
PADEL_KR2559	[!#1]O[CH]([NH]C(=O)[!#1])C(Cl)(Cl)Cl	PADEL_KR2559
PADEL_KR2560	[!#1]O[CH](C(F)(F)F)C(F)(F)F	PADEL_KR2560
PADEL_KR2561	[!#1]O[CH](F)F	PADEL_KR2561
PADEL_KR2562	[!#1]O[CH]1[CH2][CH]([CH3])[CH2][CH2][CH]1[CH]([CH3])[CH3]	PADEL_KR2562
PADEL_KR2563	[!#1]O[CH]1[CH2][CH2][CH]([CH2][CH2]1)C([CH3])([CH3])[CH3]	PADEL_KR2563
PADEL_KR2564	[!#1]O[CH2][CH]([!#1])[!#1]	PADEL_KR2564
PADEL_KR2565	[!#1]O[CH2][CH]([CH3])[CH3]	PADEL_KR2565
PADEL_KR2566	[!#1]O[CH2][CH]([OH])[CH2][NH][CH]([CH3])[CH3]	PADEL_KR2566
PADEL_KR2567	[!#1]O[CH2][CH]([OH])[CH2][NH]C([CH3])([CH3])[CH2]C([CH3])([CH3])[CH3]	PADEL_KR2567
PADEL_KR2568	[!#1]O[CH2][CH]([OH])[CH2][NH]C([CH3])([CH3])[CH3]	PADEL_KR2568
PADEL_KR2569	[!#1]O[CH2][CH]([OH])[CH2][NH]S(=O)(=O)[OH]	PADEL_KR2569
PADEL_KR2570	[!#1]O[CH2][CH]([OH])[CH2]N([!#1])[CH2][CH3]	PADEL_KR2570
PADEL_KR2571	[!#1]O[CH2][CH]([OH])[CH2]N([!#1])[CH3]	PADEL_KR2571
PADEL_KR2572	[!#1]O[CH2][CH]([OH])[CH2]N([CH2][CH3])[CH2][CH3]	PADEL_KR2572
PADEL_KR2573	[!#1]O[CH2][CH]([OH])[CH2]N([CH2][CH3])S(=O)(=O)[OH]	PADEL_KR2573
PADEL_KR2574	[!#1]O[CH2][CH]([OH])[CH2]N([CH3])[CH2][CH]([OH])[CH2][NH]S(=O)(=O)[OH]	PADEL_KR2574
PADEL_KR2575	[!#1]O[CH2][CH]([OH])[CH2]N([CH3])S(=O)(=O)[OH]	PADEL_KR2575
PADEL_KR2576	[!#1]O[CH2][CH]=[CH2]	PADEL_KR2576
PADEL_KR2577	[!#1]O[CH2][CH]1O[CH]([!#1])[CH](O[!#1])[CH]1O[!#1]	PADEL_KR2577
PADEL_KR2578	[!#1]O[CH2][CH2][CH]([CH3])[CH3]	PADEL_KR2578
PADEL_KR2579	[!#1]O[CH2][CH2][CH2][CH2][CH2][CH2][CH3]	PADEL_KR2579
PADEL_KR2580	[!#1]O[CH2][CH2][CH2][CH2][CH2][CH3]	PADEL_KR2580
PADEL_KR2581	[!#1]O[CH2][CH2][CH2][CH2][CH3]	PADEL_KR2581
PADEL_KR2582	[!#1]O[CH2][CH2][CH2][CH3]	PADEL_KR2582
PADEL_KR2583	[!#1]O[CH2][CH2][CH2]C(=O)[!#1]	PADEL_KR2583
PADEL_KR2584	[!#1]O[CH2][CH2][CH3]	PADEL_KR2584
PADEL_KR2585	[!#1]O[CH2][CH2][NH]C(=O)[!#1]	PADEL_KR2585
PADEL_KR2586	[!#1]O[CH2][CH2][NH2]	PADEL_KR2586
PADEL_KR2587	[!#1]O[CH2][CH2][OH]	PADEL_KR2587
PADEL_KR2588	[!#1]O[CH2][CH2]c1[cH][cH][cH][cH][cH]1	PADEL_KR2588
PADEL_KR2589	[!#1]O[CH2][CH2]Cl	PADEL_KR2589
PADEL_KR2590	[!#1]O[CH2][CH2]F	PADEL_KR2590
PADEL_KR2591	[!#1]O[CH2][CH2]N([CH2][CH3])[CH2][CH3]	PADEL_KR2591
PADEL_KR2592	[!#1]O[CH2][CH2]O[!#1]	PADEL_KR2592
PADEL_KR2593	[!#1]O[CH2][CH2]OC(=O)[!#1]	PADEL_KR2593
PADEL_KR2594	[!#1]O[CH2][CH2]S(=O)(=O)[!#1]	PADEL_KR2594
PADEL_KR2595	[!#1]O[CH2][CH3]	PADEL_KR2595
PADEL_KR2596	[!#1]O[CH2]C#[CH]	PADEL_KR2596
PADEL_KR2597	[!#1]O[CH2]C([!#1])([!#1])Cl	PADEL_KR2597
PADEL_KR2598	[!#1]O[CH2]C(=O)[!#1]	PADEL_KR2598
PADEL_KR2599	[!#1]O[CH2]C(=O)[CH3]	PADEL_KR2599
PADEL_KR2600	[!#1]O[CH2]C(=O)[NH][CH]([!#1])[CH3]	PADEL_KR2600
PADEL_KR2601	[!#1]O[CH2]C(=O)[NH][CH]([CH2][CH2]S[CH3])C(=O)O[CH3]	PADEL_KR2601
PADEL_KR2602	[!#1]O[CH2]C(=O)[NH][CH2][CH2]N([CH3])[CH3]	PADEL_KR2602
PADEL_KR2603	[!#1]O[CH2]C(=O)[NH][NH]C(=O)[!#1]	PADEL_KR2603
PADEL_KR2604	[!#1]O[CH2]C(=O)[NH][NH]C(=O)[CH2][CH2][CH2][CH2][CH3]	PADEL_KR2604
PADEL_KR2605	[!#1]O[CH2]C(=O)[NH][NH2]	PADEL_KR2605
PADEL_KR2606	[!#1]O[CH2]C(=O)[NH]C(=O)O[!#1]	PADEL_KR2606
PADEL_KR2607	[!#1]O[CH2]C(=O)[NH]N=[CH][!#1]	PADEL_KR2607
PADEL_KR2608	[!#1]O[CH2]C(=O)[NH]N=[CH][CH]([!#1])[!#1]	PADEL_KR2608
PADEL_KR2609	[!#1]O[CH2]C(=O)[NH]N=[CH][CH]=[CH][!#1]	PADEL_KR2609
PADEL_KR2610	[!#1]O[CH2]C(=O)[NH]N=[CH][CH]=[CH]c1[cH][cH][cH]c([cH]1)[N+](=O)[O-]	PADEL_KR2610
PADEL_KR2611	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH][cH][cH][cH]c1[!#1]	PADEL_KR2611
PADEL_KR2612	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH][cH][cH][cH]c1[N+](=O)[O-]	PADEL_KR2612
PADEL_KR2613	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH][cH][cH][cH]c1[OH]	PADEL_KR2613
PADEL_KR2614	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH][cH][cH][cH]c1Cl	PADEL_KR2614
PADEL_KR2615	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH][cH][cH][cH]c1O[CH3]	PADEL_KR2615
PADEL_KR2616	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH][cH][cH]c([!#1])[cH]1	PADEL_KR2616
PADEL_KR2617	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH][cH][cH]c([cH]1)[N+](=O)[O-]	PADEL_KR2617
PADEL_KR2618	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH][cH]c([!#1])[cH][cH]1	PADEL_KR2618
PADEL_KR2619	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH][cH]c([!#1])[cH]c1[OH]	PADEL_KR2619
PADEL_KR2620	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH][cH]c([cH][cH]1)[N+](=O)[O-]	PADEL_KR2620
PADEL_KR2621	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH][cH]c([CH3])o1	PADEL_KR2621
PADEL_KR2622	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH][cH]c([OH])[cH][cH]1	PADEL_KR2622
PADEL_KR2623	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH][cH]c([OH])c([cH]1)[N+](=O)[O-]	PADEL_KR2623
PADEL_KR2624	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH][cH]c(Cl)[cH][cH]1	PADEL_KR2624
PADEL_KR2625	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH][cH]c(Cl)c([cH]1)[N+](=O)[O-]	PADEL_KR2625
PADEL_KR2626	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH][cH]c(O[CH3])c([cH]1)[N+](=O)[O-]	PADEL_KR2626
PADEL_KR2627	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH][cH]c(s1)[N+](=O)[O-]	PADEL_KR2627
PADEL_KR2628	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH]c([cH][cH]c1[OH])[N+](=O)[O-]	PADEL_KR2628
PADEL_KR2629	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH]c(I)[cH]c([!#1])c1[OH]	PADEL_KR2629
PADEL_KR2630	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH]c(N=Nc2[cH][cH][cH][cH][cH]2)[cH][cH]c1[OH]	PADEL_KR2630
PADEL_KR2631	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH]c2[cH][cH][cH][cH]c2nc1Cl	PADEL_KR2631
PADEL_KR2632	[!#1]O[CH2]C(=O)[NH]N=[CH]c1[cH]c2O[CH2]Oc2[cH]c1[N+](=O)[O-]	PADEL_KR2632
PADEL_KR2633	[!#1]O[CH2]C(=O)[NH]N=[CH]c1c([OH])[cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR2633
PADEL_KR2634	[!#1]O[CH2]C(=O)[NH]N=[CH]c1c(Cl)[cH][cH][cH]c1Cl	PADEL_KR2634
PADEL_KR2635	[!#1]O[CH2]C(=O)[NH]N=[CH]c1c(O[CH3])[cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR2635
PADEL_KR2636	[!#1]O[CH2]C(=O)[NH]N=C([!#1])[CH3]	PADEL_KR2636
PADEL_KR2637	[!#1]O[CH2]C(=O)[NH]N=C([CH3])[CH]([!#1])[!#1]	PADEL_KR2637
PADEL_KR2638	[!#1]O[CH2]C(=O)[NH]N=C([CH3])[CH]=[CH][!#1]	PADEL_KR2638
PADEL_KR2639	[!#1]O[CH2]C(=O)[NH]N=C([CH3])[CH]=[CH]c1[cH][cH][cH]o1	PADEL_KR2639
PADEL_KR2640	[!#1]O[CH2]C(=O)[NH]N=C([CH3])c1[cH][cH][cH]c([cH]1)[N+](=O)[O-]	PADEL_KR2640
PADEL_KR2641	[!#1]O[CH2]C(=O)[NH]N=C([CH3])c1[cH][cH][cH]s1	PADEL_KR2641
PADEL_KR2642	[!#1]O[CH2]C(=O)[NH]N=C([CH3])c1[cH][cH]c(Br)s1	PADEL_KR2642
PADEL_KR2643	[!#1]O[CH2]C(=O)[NH]N=C(C(=O)[!#1])c1[cH]c(Br)[cH][cH]c1N([!#1])[CH3]	PADEL_KR2643
PADEL_KR2644	[!#1]O[CH2]C(=O)[NH]N=C1[CH2][CH2][CH2][CH2][CH2]1	PADEL_KR2644
PADEL_KR2645	[!#1]O[CH2]C(=O)[NH]N=C1C(=O)[NH]c2[cH][cH][cH][cH]c12	PADEL_KR2645
PADEL_KR2646	[!#1]O[CH2]C(=O)[NH]N=C1C(=O)[NH]c2[cH][cH]c([!#1])[cH]c12	PADEL_KR2646
PADEL_KR2647	[!#1]O[CH2]C(=O)[NH]N=C1C(=O)[NH]c2[cH][cH]c([cH]c12)[N+](=O)[O-]	PADEL_KR2647
PADEL_KR2648	[!#1]O[CH2]C(=O)[NH]N=C1C(=O)N([!#1])c2[cH][cH]c([!#1])[cH]c12	PADEL_KR2648
PADEL_KR2649	[!#1]O[CH2]C(=O)[NH]N=C1C(=O)N([CH3])c2[cH][cH]c(Br)[cH]c12	PADEL_KR2649
PADEL_KR2650	[!#1]O[CH2]C(=O)[NH2]	PADEL_KR2650
PADEL_KR2651	[!#1]O[CH2]C(=O)[OH]	PADEL_KR2651
PADEL_KR2652	[!#1]O[CH2]C(=O)c1[cH][cH][cH][cH][cH]1	PADEL_KR2652
PADEL_KR2653	[!#1]O[CH2]C(=O)c1[cH][cH]c([cH][cH]1)[N+](=O)[O-]	PADEL_KR2653
PADEL_KR2654	[!#1]O[CH2]C(=O)c1[cH][cH]c(Br)[cH][cH]1	PADEL_KR2654
PADEL_KR2655	[!#1]O[CH2]C(=O)c1[cH][cH]c(Cl)[cH][cH]1	PADEL_KR2655
PADEL_KR2656	[!#1]O[CH2]C(=O)c1[cH][cH]c(O[!#1])[cH][cH]1	PADEL_KR2656
PADEL_KR2657	[!#1]O[CH2]C(=O)N([!#1])[CH2][CH3]	PADEL_KR2657
PADEL_KR2658	[!#1]O[CH2]C(=O)N([!#1])[CH3]	PADEL_KR2658
PADEL_KR2659	[!#1]O[CH2]C(=O)N([CH2][CH3])[CH2][CH3]	PADEL_KR2659
PADEL_KR2660	[!#1]O[CH2]C(=O)O[!#1]	PADEL_KR2660
PADEL_KR2661	[!#1]O[CH2]C(=O)O[CH2]C(=O)[!#1]	PADEL_KR2661
PADEL_KR2662	[!#1]O[CH2]C(=O)O[CH3]	PADEL_KR2662
PADEL_KR2663	[!#1]O[CH2]C(=O)ON=[CH]c1[cH][cH]c(Br)[cH][cH]1	PADEL_KR2663
PADEL_KR2664	[!#1]O[CH2]C(=O)ON=C([CH3])C([CH3])([CH3])[CH3]	PADEL_KR2664
PADEL_KR2665	[!#1]O[CH2]C(F)(F)F	PADEL_KR2665
PADEL_KR2666	[!#1]O[CH2]c1[cH][cH][cH][cH][cH]1	PADEL_KR2666
PADEL_KR2667	[!#1]O[CH3]	PADEL_KR2667
PADEL_KR2668	[!#1]OC([!#1])([!#1])C(=O)[!#1]	PADEL_KR2668
PADEL_KR2669	[!#1]OC([!#1])([!#1])c1[cH][cH][cH][cH]c1C(=O)[!#1]	PADEL_KR2669
PADEL_KR2670	[!#1]OC([!#1])([!#1])c1[cH][cH][cH][cH]c1C(=O)C([!#1])([!#1])c2[cH][cH][cH][cH][cH]2	PADEL_KR2670
PADEL_KR2671	[!#1]OC([!#1])([!#1])c1[cH]c([CH3])[nH]c(=O)c1C(=O)[!#1]	PADEL_KR2671
PADEL_KR2672	[!#1]OC([CH3])([CH3])[CH3]	PADEL_KR2672
PADEL_KR2673	[!#1]OC(=O)[!#1]	PADEL_KR2673
PADEL_KR2674	[!#1]OC(=O)[CH]([CH3])[NH]C(=O)OC([CH3])([CH3])[CH3]	PADEL_KR2674
PADEL_KR2675	[!#1]OC(=O)[CH]=[CH][!#1]	PADEL_KR2675
PADEL_KR2676	[!#1]OC(=O)[CH]=[CH]c1[cH][cH][cH][cH][cH]1	PADEL_KR2676
PADEL_KR2677	[!#1]OC(=O)[CH2][CH2][CH2]C(=O)O[!#1]	PADEL_KR2677
PADEL_KR2678	[!#1]OC(=O)[CH2][CH2][CH3]	PADEL_KR2678
PADEL_KR2679	[!#1]OC(=O)[CH2][CH2]C(=O)O[CH3]	PADEL_KR2679
PADEL_KR2680	[!#1]OC(=O)[CH2][CH3]	PADEL_KR2680
PADEL_KR2681	[!#1]OC(=O)[CH2]C(=O)[CH3]	PADEL_KR2681
PADEL_KR2682	[!#1]OC(=O)[CH3]	PADEL_KR2682
PADEL_KR2683	[!#1]OC(=O)[NH][CH3]	PADEL_KR2683
PADEL_KR2684	[!#1]OC(=O)[NH]C(=O)[CH2][CH2]Br	PADEL_KR2684
PADEL_KR2685	[!#1]OC(=O)[NH2]	PADEL_KR2685
PADEL_KR2686	[!#1]OC(=O)C(=[CH2])[CH3]	PADEL_KR2686
PADEL_KR2687	[!#1]OC(=O)C(F)(F)F	PADEL_KR2687
PADEL_KR2688	[!#1]OC(=O)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F	PADEL_KR2688
PADEL_KR2689	[!#1]OC(=O)O[CH3]	PADEL_KR2689
PADEL_KR2690	[!#1]OC(C(=O)[!#1])(c1[cH][cH][cH][cH][cH]1)c2[cH][cH][cH][cH][cH]2	PADEL_KR2690
PADEL_KR2691	[!#1]OC(F)(F)[CH](F)Cl	PADEL_KR2691
PADEL_KR2692	[!#1]OC(F)(F)[CH](F)F	PADEL_KR2692
PADEL_KR2693	[!#1]OC1([CH2][CH2][CH2][CH2][CH2]1)C([!#1])([!#1])[!#1]	PADEL_KR2693
PADEL_KR2694	[!#1]Oc1[cH][cH][cH][cH][cH]1	PADEL_KR2694
PADEL_KR2695	[!#1]Oc1[cH][cH][cH][cH]c1[!#1]	PADEL_KR2695
PADEL_KR2696	[!#1]Oc1[cH][cH][cH][cH]c1[N+](=O)[O-]	PADEL_KR2696
PADEL_KR2697	[!#1]Oc1[cH][cH][cH][cH]c1[NH]C(=O)[!#1]	PADEL_KR2697
PADEL_KR2698	[!#1]Oc1[cH][cH][cH][cH]c1[OH]	PADEL_KR2698
PADEL_KR2699	[!#1]Oc1[cH][cH][cH][cH]c1C(=O)[!#1]	PADEL_KR2699
PADEL_KR2700	[!#1]Oc1[cH][cH][cH][cH]c1F	PADEL_KR2700
PADEL_KR2701	[!#1]Oc1[cH][cH][cH][cH]c1N([!#1])C(=O)[CH]([!#1])[CH2]C(=O)[!#1]	PADEL_KR2701
PADEL_KR2702	[!#1]Oc1[cH][cH][cH][cH]c1O[!#1]	PADEL_KR2702
PADEL_KR2703	[!#1]Oc1[cH][cH][cH]c([!#1])[cH]1	PADEL_KR2703
PADEL_KR2704	[!#1]Oc1[cH][cH][cH]c([CH]=N[!#1])c1[OH]	PADEL_KR2704
PADEL_KR2705	[!#1]Oc1[cH][cH][cH]c([cH]1)[N+](=O)[O-]	PADEL_KR2705
PADEL_KR2706	[!#1]Oc1[cH][cH][cH]c([cH]1)C(=O)[!#1]	PADEL_KR2706
PADEL_KR2707	[!#1]Oc1[cH][cH][cH]c([CH3])[cH]1	PADEL_KR2707
PADEL_KR2708	[!#1]Oc1[cH][cH][cH]c2[cH][cH][cH][cH]c12	PADEL_KR2708
PADEL_KR2709	[!#1]Oc1[cH][cH][cH]c2[cH][cH][cH]nc12	PADEL_KR2709
PADEL_KR2710	[!#1]Oc1[cH][cH][cH]nc1[!#1]	PADEL_KR2710
PADEL_KR2711	[!#1]Oc1[cH][cH]c([!#1])[cH][cH]1	PADEL_KR2711
PADEL_KR2712	[!#1]Oc1[cH][cH]c([!#1])[cH]c1[!#1]	PADEL_KR2712
PADEL_KR2713	[!#1]Oc1[cH][cH]c([!#1])[cH]c1Br	PADEL_KR2713
PADEL_KR2714	[!#1]Oc1[cH][cH]c([!#1])[cH]c1O[!#1]	PADEL_KR2714
PADEL_KR2715	[!#1]Oc1[cH][cH]c([!#1])c([cH]1)[N+](=O)[O-]	PADEL_KR2715
PADEL_KR2716	[!#1]Oc1[cH][cH]c([cH][cH]1)[CH]([!#1])[!#1]	PADEL_KR2716
PADEL_KR2717	[!#1]Oc1[cH][cH]c([cH][cH]1)[N+](=O)[O-]	PADEL_KR2717
PADEL_KR2718	[!#1]Oc1[cH][cH]c([cH][cH]1)C([CH3])([CH3])[CH3]	PADEL_KR2718
PADEL_KR2719	[!#1]Oc1[cH][cH]c([cH][cH]1)C([CH3])([CH3])c2[cH][cH]c([!#1])[cH][cH]2	PADEL_KR2719
PADEL_KR2720	[!#1]Oc1[cH][cH]c([cH][cH]1)C([CH3])([CH3])c2[cH][cH]c(O[!#1])[cH][cH]2	PADEL_KR2720
PADEL_KR2721	[!#1]Oc1[cH][cH]c([cH][cH]1)C(=O)[!#1]	PADEL_KR2721
PADEL_KR2722	[!#1]Oc1[cH][cH]c([cH][cH]1)C(=O)[OH]	PADEL_KR2722
PADEL_KR2723	[!#1]Oc1[cH][cH]c([cH][cH]1)C(c2[cH][cH][cH][cH]c2[!#1])(c3[cH][cH][cH][cH]c3[!#1])c4[cH][cH]c(O[!#1])[cH][cH]4	PADEL_KR2723
PADEL_KR2724	[!#1]Oc1[cH][cH]c([cH][cH]1)C(O[!#1])(c2[cH][cH][cH][cH][cH]2)c3[cH][cH]c([!#1])[cH][cH]3	PADEL_KR2724
PADEL_KR2725	[!#1]Oc1[cH][cH]c([cH][cH]1)N([!#1])[CH2]c2[cH][cH]c(Br)[cH][cH]2	PADEL_KR2725
PADEL_KR2726	[!#1]Oc1[cH][cH]c([cH][cH]1)N([!#1])[CH2]c2[cH][cH]c(F)[cH][cH]2	PADEL_KR2726
PADEL_KR2727	[!#1]Oc1[cH][cH]c([cH][cH]1)N([!#1])C(=O)[CH]([!#1])[CH2]C(=O)[!#1]	PADEL_KR2727
PADEL_KR2728	[!#1]Oc1[cH][cH]c([cH][cH]1)N([!#1])C(=O)[CH]([CH2]C(=O)[!#1])S[CH2]C(=O)[!#1]	PADEL_KR2728
PADEL_KR2729	[!#1]Oc1[cH][cH]c([cH][cH]1)S(=O)(=O)[!#1]	PADEL_KR2729
PADEL_KR2730	[!#1]Oc1[cH][cH]c([cH][cH]1)S(=O)(=O)c2[cH][cH]c([!#1])[cH][cH]2	PADEL_KR2730
PADEL_KR2731	[!#1]Oc1[cH][cH]c([CH]=N[!#1])[cH][cH]1	PADEL_KR2731
PADEL_KR2732	[!#1]Oc1[cH][cH]c([CH]=N[!#1])[cH]c1[OH]	PADEL_KR2732
PADEL_KR2733	[!#1]Oc1[cH][cH]c([CH]=N[!#1])[cH]c1O[!#1]	PADEL_KR2733
PADEL_KR2734	[!#1]Oc1[cH][cH]c([CH]=N[!#1])c(O[!#1])[cH]1	PADEL_KR2734
PADEL_KR2735	[!#1]Oc1[cH][cH]c([CH]=O)[cH][cH]1	PADEL_KR2735
PADEL_KR2736	[!#1]Oc1[cH][cH]c([cH]c1O[!#1])[CH]([!#1])[!#1]	PADEL_KR2736
PADEL_KR2737	[!#1]Oc1[cH][cH]c([cH]c1O[!#1])C(=O)[!#1]	PADEL_KR2737
PADEL_KR2738	[!#1]Oc1[cH][cH]c([CH2][CH2]N([!#1])[CH3])[cH]c1O[!#1]	PADEL_KR2738
PADEL_KR2739	[!#1]Oc1[cH][cH]c([CH2]C(=O)[!#1])[cH][cH]1	PADEL_KR2739
PADEL_KR2740	[!#1]Oc1[cH][cH]c([CH2]C(=O)[!#1])[cH]c1O[!#1]	PADEL_KR2740
PADEL_KR2741	[!#1]Oc1[cH][cH]c([CH3])[cH][cH]1	PADEL_KR2741
PADEL_KR2742	[!#1]Oc1[cH][cH]c([CH3])[cH]c1[CH3]	PADEL_KR2742
PADEL_KR2743	[!#1]Oc1[cH][cH]c([CH3])[cH]c1[N+](=O)[O-]	PADEL_KR2743
PADEL_KR2744	[!#1]Oc1[cH][cH]c([CH3])c([CH3])[cH]1	PADEL_KR2744
PADEL_KR2745	[!#1]Oc1[cH][cH]c([NH]C(=O)[!#1])[cH]c1Cl	PADEL_KR2745
PADEL_KR2746	[!#1]Oc1[cH][cH]c([NH2])[cH][cH]1	PADEL_KR2746
PADEL_KR2747	[!#1]Oc1[cH][cH]c([OH])[cH][cH]1	PADEL_KR2747
PADEL_KR2748	[!#1]Oc1[cH][cH]c(Br)[cH][cH]1	PADEL_KR2748
PADEL_KR2749	[!#1]Oc1[cH][cH]c(C(=O)[OH])c([cH]1)C(=O)[OH]	PADEL_KR2749
PADEL_KR2750	[!#1]Oc1[cH][cH]c(Cl)[cH][cH]1	PADEL_KR2750
PADEL_KR2751	[!#1]Oc1[cH][cH]c(Cl)[cH]c1Cl	PADEL_KR2751
PADEL_KR2752	[!#1]Oc1[cH][cH]c(O[!#1])[cH][cH]1	PADEL_KR2752
PADEL_KR2753	[!#1]Oc1[cH][cH]c2[cH][cH][cH][cH]c2[cH]1	PADEL_KR2753
PADEL_KR2754	[!#1]Oc1[cH][cH]c2[cH][cH][cH][cH]c2c1[CH2]c3c(O[!#1])[cH][cH]c4[cH][cH][cH][cH]c34	PADEL_KR2754
PADEL_KR2755	[!#1]Oc1[cH][cH]c2[cH][cH][cH][cH]c2c1Br	PADEL_KR2755
PADEL_KR2756	[!#1]Oc1[cH][cH]c2c([CH3])[cH]c(=O)oc2[cH]1	PADEL_KR2756
PADEL_KR2757	[!#1]Oc1[cH][cH]c2c(=O)c([!#1])[cH]oc2[cH]1	PADEL_KR2757
PADEL_KR2758	[!#1]Oc1[cH][cH]c2c(=O)c([!#1])c([CH3])oc2[cH]1	PADEL_KR2758
PADEL_KR2759	[!#1]Oc1[cH][cH]c2C(=O)OC(=O)c2[cH]1	PADEL_KR2759
PADEL_KR2760	[!#1]Oc1[cH]c([cH][cH]c1[!#1])[CH]([!#1])[!#1]	PADEL_KR2760
PADEL_KR2761	[!#1]Oc1[cH]c([cH][cH]c1[OH])[CH]([!#1])[!#1]	PADEL_KR2761
PADEL_KR2762	[!#1]Oc1[cH]c([CH]=N[!#1])[cH][cH]c1[OH]	PADEL_KR2762
PADEL_KR2763	[!#1]Oc1[cH]c([cH]c(O[!#1])c1O[!#1])C(=O)[!#1]	PADEL_KR2763
PADEL_KR2764	[!#1]Oc1[cH]c([CH3])[cH]c(O[!#1])[cH]1	PADEL_KR2764
PADEL_KR2765	[!#1]Oc1[cH]c(Br)[cH]c([CH]=N[!#1])c1[OH]	PADEL_KR2765
PADEL_KR2766	[!#1]Oc1c([!#1])[cH][cH][cH]c1[CH]([!#1])[!#1]	PADEL_KR2766
PADEL_KR2767	[!#1]Oc1c([CH3])[cH]c(Br)[cH]c1[CH3]	PADEL_KR2767
PADEL_KR2768	[!#1]Oc1c(Br)[cH]c(Br)c2[cH][cH][cH]nc12	PADEL_KR2768
PADEL_KR2769	[!#1]Oc1c(Cl)[cH]c(Cl)[cH]c1C(=O)[!#1]	PADEL_KR2769
PADEL_KR2770	[!#1]Oc1c(F)c(F)c([!#1])c(F)c1F	PADEL_KR2770
PADEL_KR2771	[!#1]OP(=O)([OH])O[!#1]	PADEL_KR2771
PADEL_KR2772	[!#1]OP(=O)(O[!#1])O[!#1]	PADEL_KR2772
PADEL_KR2773	[!#1]OS(=O)(=O)[!#1]	PADEL_KR2773
PADEL_KR2774	[!#1]OS(=O)(=O)[CH2][CH2]S(=O)(=O)[!#1]	PADEL_KR2774
PADEL_KR2775	[!#1]OS(=O)(=O)[CH2][CH2]S[!#1]	PADEL_KR2775
PADEL_KR2776	[!#1]OS(=O)(=O)[CH3]	PADEL_KR2776
PADEL_KR2777	[!#1]OS(=O)(=O)[OH]	PADEL_KR2777
PADEL_KR2778	[!#1]P(=O)([OH])O[CH2][CH3]	PADEL_KR2778
PADEL_KR2779	[!#1]P(=O)(O[CH3])O[CH3]	PADEL_KR2779
PADEL_KR2780	[!#1]P1(=O)O[CH2][CH2][CH2]O1	PADEL_KR2780
PADEL_KR2781	[!#1]S(=O)(=O)[!#1]	PADEL_KR2781
PADEL_KR2782	[!#1]S(=O)(=O)[CH]1[CH2][CH2]S(=O)(=O)[CH2]1	PADEL_KR2782
PADEL_KR2783	[!#1]S(=O)(=O)[CH2][CH2][CH2][CH2][CH2][CH3]	PADEL_KR2783
PADEL_KR2784	[!#1]S(=O)(=O)[CH2][CH2][OH]	PADEL_KR2784
PADEL_KR2785	[!#1]S(=O)(=O)[CH2][CH2]C(=O)[CH3]	PADEL_KR2785
PADEL_KR2786	[!#1]S(=O)(=O)[CH2][CH2]C(=O)[OH]	PADEL_KR2786
PADEL_KR2787	[!#1]S(=O)(=O)[CH2][CH2]C(=O)O[CH2][CH3]	PADEL_KR2787
PADEL_KR2788	[!#1]S(=O)(=O)[CH2][CH2]C(=O)O[CH3]	PADEL_KR2788
PADEL_KR2789	[!#1]S(=O)(=O)[CH2][CH3]	PADEL_KR2789
PADEL_KR2790	[!#1]S(=O)(=O)[CH2]Br	PADEL_KR2790
PADEL_KR2791	[!#1]S(=O)(=O)[CH2]C(=N[NH]C(=S)[NH2])[CH3]	PADEL_KR2791
PADEL_KR2792	[!#1]S(=O)(=O)[CH2]C(=O)[CH3]	PADEL_KR2792
PADEL_KR2793	[!#1]S(=O)(=O)[CH2]C(=O)[NH2]	PADEL_KR2793
PADEL_KR2794	[!#1]S(=O)(=O)[CH2]C(=O)[OH]	PADEL_KR2794
PADEL_KR2795	[!#1]S(=O)(=O)[CH2]OC(=O)[CH3]	PADEL_KR2795
PADEL_KR2796	[!#1]S(=O)(=O)[CH3]	PADEL_KR2796
PADEL_KR2797	[!#1]S(=O)(=O)[NH][CH]([CH]([CH3])[CH3])C(=O)[OH]	PADEL_KR2797
PADEL_KR2798	[!#1]S(=O)(=O)[NH][CH]([CH2][CH2][CH3])C(=O)[OH]	PADEL_KR2798
PADEL_KR2799	[!#1]S(=O)(=O)[NH][CH]([CH3])[CH3]	PADEL_KR2799
PADEL_KR2800	[!#1]S(=O)(=O)[NH][CH2][CH2][CH2][CH2][CH2][CH3]	PADEL_KR2800
PADEL_KR2801	[!#1]S(=O)(=O)[NH][CH2][CH2][CH2][CH2][CH2]C(=O)[OH]	PADEL_KR2801
PADEL_KR2802	[!#1]S(=O)(=O)[NH][CH2][CH2][CH2][CH3]	PADEL_KR2802
PADEL_KR2803	[!#1]S(=O)(=O)[NH][CH2][CH2][CH2][OH]	PADEL_KR2803
PADEL_KR2804	[!#1]S(=O)(=O)[NH][CH2][CH2][CH2]C(=O)[OH]	PADEL_KR2804
PADEL_KR2805	[!#1]S(=O)(=O)[NH][CH2][CH2][OH]	PADEL_KR2805
PADEL_KR2806	[!#1]S(=O)(=O)[NH][CH2][CH2]C(=O)[OH]	PADEL_KR2806
PADEL_KR2807	[!#1]S(=O)(=O)[NH][CH2][CH2]OC(=O)[NH][CH2][CH2][CH2][CH3]	PADEL_KR2807
PADEL_KR2808	[!#1]S(=O)(=O)[NH][CH2]C(=O)[OH]	PADEL_KR2808
PADEL_KR2809	[!#1]S(=O)(=O)[NH][CH2]C(=O)O[CH2][CH3]	PADEL_KR2809
PADEL_KR2810	[!#1]S(=O)(=O)[NH][CH3]	PADEL_KR2810
PADEL_KR2811	[!#1]S(=O)(=O)[NH]C([CH3])([CH3])[CH3]	PADEL_KR2811
PADEL_KR2812	[!#1]S(=O)(=O)[NH]C(=O)[CH3]	PADEL_KR2812
PADEL_KR2813	[!#1]S(=O)(=O)[NH]C(=O)[NH2]	PADEL_KR2813
PADEL_KR2814	[!#1]S(=O)(=O)[NH]C(=O)O[CH2][CH2]N([CH2][CH3])[CH2][CH3]	PADEL_KR2814
PADEL_KR2815	[!#1]S(=O)(=O)[NH2]	PADEL_KR2815
PADEL_KR2816	[!#1]S(=O)(=O)[OH]	PADEL_KR2816
PADEL_KR2817	[!#1]S(=O)(=O)C([CH3])([CH3])[CH2]C(=O)[CH3]	PADEL_KR2817
PADEL_KR2818	[!#1]S(=O)(=O)C([CH3])([CH3])[CH3]	PADEL_KR2818
PADEL_KR2819	[!#1]S(=O)(=O)C(F)(F)F	PADEL_KR2819
PADEL_KR2820	[!#1]S(=O)(=O)c1[cH][cH][cH][cH][cH]1	PADEL_KR2820
PADEL_KR2821	[!#1]S(=O)(=O)c1[cH][cH][cH][cH]c1[N+](=O)[O-]	PADEL_KR2821
PADEL_KR2822	[!#1]S(=O)(=O)c1[cH][cH][cH][cH]c1Cl	PADEL_KR2822
PADEL_KR2823	[!#1]S(=O)(=O)c1[cH][cH][cH]c([cH]1)[N+](=O)[O-]	PADEL_KR2823
PADEL_KR2824	[!#1]S(=O)(=O)c1[cH][cH][cH]c([cH]1)C(F)(F)F	PADEL_KR2824
PADEL_KR2825	[!#1]S(=O)(=O)c1[cH][cH][cH]c([cH]1)S(=O)(=O)c2[cH][cH]c(Cl)[cH][cH]2	PADEL_KR2825
PADEL_KR2826	[!#1]S(=O)(=O)c1[cH][cH][cH]c([cH]1)S(=O)(=O)c2[cH][cH]c(Cl)c(Cl)[cH]2	PADEL_KR2826
PADEL_KR2827	[!#1]S(=O)(=O)c1[cH][cH][cH]c2[cH][cH][cH]nc12	PADEL_KR2827
PADEL_KR2828	[!#1]S(=O)(=O)c1[cH][cH][cH]c2nsnc12	PADEL_KR2828
PADEL_KR2829	[!#1]S(=O)(=O)c1[cH][cH]c([cH][cH]1)[CH]2[CH2][CH2][CH2][CH2][CH2]2	PADEL_KR2829
PADEL_KR2830	[!#1]S(=O)(=O)c1[cH][cH]c([cH][cH]1)[N+](=O)[O-]	PADEL_KR2830
PADEL_KR2831	[!#1]S(=O)(=O)c1[cH][cH]c([cH][cH]1)C([CH3])([CH3])[CH3]	PADEL_KR2831
PADEL_KR2832	[!#1]S(=O)(=O)c1[cH][cH]c([cH][cH]1)C(=O)[OH]	PADEL_KR2832
PADEL_KR2833	[!#1]S(=O)(=O)c1[cH][cH]c([CH3])[cH][cH]1	PADEL_KR2833
PADEL_KR2834	[!#1]S(=O)(=O)c1[cH][cH]c([CH3])c([cH]1)[N+](=O)[O-]	PADEL_KR2834
PADEL_KR2835	[!#1]S(=O)(=O)c1[cH][cH]c(Br)[cH][cH]1	PADEL_KR2835
PADEL_KR2836	[!#1]S(=O)(=O)c1[cH][cH]c(Cl)[cH][cH]1	PADEL_KR2836
PADEL_KR2837	[!#1]S(=O)(=O)c1[cH][cH]c(Cl)c([cH]1)[N+](=O)[O-]	PADEL_KR2837
PADEL_KR2838	[!#1]S(=O)(=O)c1[cH][cH]c(Cl)c(Cl)[cH]1	PADEL_KR2838
PADEL_KR2839	[!#1]S(=O)(=O)c1[cH][cH]c(S(c2[cH][cH]c([cH][cH]2)S(=O)(=O)[!#1]))[cH][cH]1	PADEL_KR2839
PADEL_KR2840	[!#1]S(=O)(=O)c1[cH][cH]c2[cH][cH][cH][cH]c2[cH]1	PADEL_KR2840
PADEL_KR2841	[!#1]S(=O)(=O)c1c([cH]c([cH]c1[CH]([CH3])[CH3])[CH]([CH3])[CH3])[CH]([CH3])[CH3]	PADEL_KR2841
PADEL_KR2842	[!#1]S(=O)(=O)c1c([CH3])[cH]c([CH3])[cH]c1[CH3]	PADEL_KR2842
PADEL_KR2843	[!#1]S(=O)(=O)N([CH2][CH]([CH3])[CH3])[CH2][CH]([CH3])[CH3]	PADEL_KR2843
PADEL_KR2844	[!#1]S(=O)(=O)N([CH2][CH2][CH2][CH3])[CH2][CH2]C(=O)[NH2]	PADEL_KR2844
PADEL_KR2845	[!#1]S(=O)(=O)N([CH2][CH2][CH3])[CH2][CH2][CH3]	PADEL_KR2845
PADEL_KR2846	[!#1]S(=O)(=O)N([CH2][CH2][OH])[CH2][CH2][OH]	PADEL_KR2846
PADEL_KR2847	[!#1]S(=O)(=O)N([CH2][CH3])[CH2][CH3]	PADEL_KR2847
PADEL_KR2848	[!#1]S(=O)(=O)N([CH3])[CH3]	PADEL_KR2848
PADEL_KR2849	[!#1]S(=O)(=O)N1[CH2][CH2][CH2][CH2][CH2]1	PADEL_KR2849
PADEL_KR2850	[!#1]S(=O)(=O)N1[CH2][CH2]O[CH2][CH2]1	PADEL_KR2850
PADEL_KR2851	[!#1]S(=O)(=O)O[CH2][CH2]S(=O)(=O)[CH2][CH3]	PADEL_KR2851
PADEL_KR2852	[!#1]S(=O)(=O)O[CH3]	PADEL_KR2852
PADEL_KR2853	[!#1]S(=O)(=O)O[K]	PADEL_KR2853
PADEL_KR2854	[!#1]S(=O)(=O)O[Na]	PADEL_KR2854
PADEL_KR2855	[!#1]S[!#1]	PADEL_KR2855
PADEL_KR2856	[!#1]S[CH]([!#1])[!#1]	PADEL_KR2856
PADEL_KR2857	[!#1]S[CH]([!#1])[CH2]C(=O)[!#1]	PADEL_KR2857
PADEL_KR2858	[!#1]S[CH]([!#1])C(=O)[OH]	PADEL_KR2858
PADEL_KR2859	[!#1]S[CH]([NH]C(=O)[!#1])C(=O)[!#1]	PADEL_KR2859
PADEL_KR2860	[!#1]S[CH]([NH]C(=O)[!#1])C(Cl)(Cl)Cl	PADEL_KR2860
PADEL_KR2861	[!#1]S[CH2][CH2][CH2]S(=O)(=O)[OH]	PADEL_KR2861
PADEL_KR2862	[!#1]S[CH2][CH2][NH2]	PADEL_KR2862
PADEL_KR2863	[!#1]S[CH2][CH2][OH]	PADEL_KR2863
PADEL_KR2864	[!#1]S[CH2][CH2]C(F)(F)F	PADEL_KR2864
PADEL_KR2865	[!#1]S[CH2][CH2]S(=O)(=O)[!#1]	PADEL_KR2865
PADEL_KR2866	[!#1]S[CH2][CH2]S[!#1]	PADEL_KR2866
PADEL_KR2867	[!#1]S[CH2][CH2]SC(=[NH])[NH2]	PADEL_KR2867
PADEL_KR2868	[!#1]S[CH2][CH3]	PADEL_KR2868
PADEL_KR2869	[!#1]S[CH2][NH]C(=O)[!#1]	PADEL_KR2869
PADEL_KR2870	[!#1]S[CH2]C(=O)[!#1]	PADEL_KR2870
PADEL_KR2871	[!#1]S[CH2]C(=O)[CH3]	PADEL_KR2871
PADEL_KR2872	[!#1]S[CH2]C(=O)[NH]N=[CH][!#1]	PADEL_KR2872
PADEL_KR2873	[!#1]S[CH2]C(=O)[NH2]	PADEL_KR2873
PADEL_KR2874	[!#1]S[CH2]C(=O)[OH]	PADEL_KR2874
PADEL_KR2875	[!#1]S[CH2]C(=O)O[CH2][CH3]	PADEL_KR2875
PADEL_KR2876	[!#1]S[CH3]	PADEL_KR2876
PADEL_KR2877	[!#1]SC([CH3])([CH3])[CH3]	PADEL_KR2877
PADEL_KR2878	[!#1]SC(=[NH])[NH]N=[CH][!#1]	PADEL_KR2878
PADEL_KR2879	[!#1]SC(=[NH])[NH2]	PADEL_KR2879
PADEL_KR2880	[!#1]SC(=C(Cl)Cl)[NH]C(=O)[!#1]	PADEL_KR2880
PADEL_KR2881	[!#1]SC(=N[CH2][CH3])[NH][CH2][CH3]	PADEL_KR2881
PADEL_KR2882	[!#1]SC(=O)[!#1]	PADEL_KR2882
PADEL_KR2883	[!#1]SC(F)(F)C(F)(F)C(F)(F)F	PADEL_KR2883
PADEL_KR2884	[!#1]SC(F)(F)F	PADEL_KR2884
PADEL_KR2885	[!#1]S(c1[cH][cH][cH][cH][cH]1)	PADEL_KR2885
PADEL_KR2886	[!#1]S(c1[cH][cH]c([!#1])[cH][cH]1)	PADEL_KR2886
PADEL_KR2887	[!#1]S(c1nc2[cH][cH][cH][cH]c2s1)	PADEL_KR2887
PADEL_KR2888	[Na]OS(=O)=O	PADEL_KR2888
PADEL_KR2889	[O-][N+](=O)c1cc([N+](=O)[O-])c2ccccc2c1	PADEL_KR2889
PADEL_KR2890	[O-][N+](=O)c1cc(C=O)cc(c1)[N+](=O)[O-]	PADEL_KR2890
PADEL_KR2891	[O-][N+](=O)c1cc(C=O)ccc1Br	PADEL_KR2891
PADEL_KR2892	[O-][N+](=O)c1cc(C=O)ccc1Cl	PADEL_KR2892
PADEL_KR2893	[O-][N+](=O)c1cc(cc(c1)C(F)(F)F)[N+](=O)[O-]	PADEL_KR2893
PADEL_KR2894	[O-][N+](=O)c1cc(ccc1Cl)S(=O)=O	PADEL_KR2894
PADEL_KR2895	[O-][N+](=O)c1cc(NC=O)ccc1Cl	PADEL_KR2895
PADEL_KR2896	[O-][N+](=O)c1cc2ccccc2oc1=O	PADEL_KR2896
PADEL_KR2897	[O-][N+](=O)c1cc2OCOc2cc1C=N	PADEL_KR2897
PADEL_KR2898	[O-][N+](=O)c1cc2OCOc2cc1C=NNC=O	PADEL_KR2898
PADEL_KR2899	[O-][N+](=O)c1ccc(C=N)cc1	PADEL_KR2899
PADEL_KR2900	[O-][N+](=O)c1ccc(C=N)s1	PADEL_KR2900
PADEL_KR2901	[O-][N+](=O)c1ccc(C=NNC=O)cc1	PADEL_KR2901
PADEL_KR2902	[O-][N+](=O)c1ccc(C=NNC=O)o1	PADEL_KR2902
PADEL_KR2903	[O-][N+](=O)c1ccc(C=O)c(C=O)c1	PADEL_KR2903
PADEL_KR2904	[O-][N+](=O)c1ccc(C=O)c(c1)[N+](=O)[O-]	PADEL_KR2904
PADEL_KR2905	[O-][N+](=O)c1ccc(C=O)cc1	PADEL_KR2905
PADEL_KR2906	[O-][N+](=O)c1ccc(cc1)C(=O)CCC(Cl)(Cl)Cl	PADEL_KR2906
PADEL_KR2907	[O-][N+](=O)c1ccc(cc1)C(=O)NN=Cc2ccccc2	PADEL_KR2907
PADEL_KR2908	[O-][N+](=O)c1ccc(cc1)N2CCNCC2	PADEL_KR2908
PADEL_KR2909	[O-][N+](=O)c1ccc(cc1)N2N=C(CC2=O)c3ccccc3	PADEL_KR2909
PADEL_KR2910	[O-][N+](=O)c1ccc(cc1)S(=O)=O	PADEL_KR2910
PADEL_KR2911	[O-][N+](=O)c1ccc(CCC=O)cc1	PADEL_KR2911
PADEL_KR2912	[O-][N+](=O)c1ccc(Cl)c(C=O)c1	PADEL_KR2912
PADEL_KR2913	[O-][N+](=O)c1ccc(Cl)cc1	PADEL_KR2913
PADEL_KR2914	[O-][N+](=O)c1ccc(NC(=S)NCC(Cl)(Cl)Cl)cc1	PADEL_KR2914
PADEL_KR2915	[O-][N+](=O)c1ccc(NC=O)cc1	PADEL_KR2915
PADEL_KR2916	[O-][N+](=O)c1ccc(NN=C(C=O)C=O)cc1	PADEL_KR2916
PADEL_KR2917	[O-][N+](=O)c1ccc2C(=O)NC(=O)c2c1	PADEL_KR2917
PADEL_KR2918	[O-][N+](=O)c1ccc2nc3c(cc2c1)[nH]c4ccccc43	PADEL_KR2918
PADEL_KR2919	[O-][N+](=O)c1ccc2nonc2c1	PADEL_KR2919
PADEL_KR2920	[O-][N+](=O)c1cccc(Br)c1	PADEL_KR2920
PADEL_KR2921	[O-][N+](=O)c1cccc(C=N)c1	PADEL_KR2921
PADEL_KR2922	[O-][N+](=O)c1cccc(C=NNC=O)c1	PADEL_KR2922
PADEL_KR2923	[O-][N+](=O)c1cccc(C=O)c1	PADEL_KR2923
PADEL_KR2924	[O-][N+](=O)c1cccc(C=O)c1C=O	PADEL_KR2924
PADEL_KR2925	[O-][N+](=O)c1cccc(c1)[N+](=O)[O-]	PADEL_KR2925
PADEL_KR2926	[O-][N+](=O)c1cccc(c1)C(F)(F)F	PADEL_KR2926
PADEL_KR2927	[O-][N+](=O)c1cccc(c1)S(=O)=O	PADEL_KR2927
PADEL_KR2928	[O-][N+](=O)c1cccc(Cl)c1	PADEL_KR2928
PADEL_KR2929	[O-][N+](=O)c1cccc(NC(=S)NCC(Cl)(Cl)Cl)c1	PADEL_KR2929
PADEL_KR2930	[O-][N+](=O)c1cccc(NC=O)c1	PADEL_KR2930
PADEL_KR2931	[O-][N+](=O)c1cccc(NS(=O)=O)c1	PADEL_KR2931
PADEL_KR2932	[O-][N+](=O)c1cccc2nonc12	PADEL_KR2932
PADEL_KR2933	[O-][N+](=O)c1cccc2nsnc12	PADEL_KR2933
PADEL_KR2934	[O-][N+](=O)c1ccccc1	PADEL_KR2934
PADEL_KR2935	[O-][N+](=O)c1ccccc1C=N	PADEL_KR2935
PADEL_KR2936	[O-][N+](=O)c1ccccc1C=NNC=O	PADEL_KR2936
PADEL_KR2937	[O-][N+](=O)c1ccccc1C=O	PADEL_KR2937
PADEL_KR2938	[O-][N+](=O)c1ccccc1Cl	PADEL_KR2938
PADEL_KR2939	[O-][N+](=O)c1ccccc1NC(=S)NCC(Cl)(Cl)Cl	PADEL_KR2939
PADEL_KR2940	[O-][N+](=O)c1ccccc1NC=O	PADEL_KR2940
PADEL_KR2941	[O-][N+](=O)c1ccccc1S(=O)=O	PADEL_KR2941
PADEL_KR2942	[O-][N+](=O)c1cn[nH]c1C=O	PADEL_KR2942
PADEL_KR2943	[O-][N+](=O)c1nc[nH]c1C=O	PADEL_KR2943
PADEL_KR2944	[O-][N+](=O)CCCl	PADEL_KR2944
PADEL_KR2945	[O-][N+](=O)NC(=N)NN=C	PADEL_KR2945
PADEL_KR2946	[O-][n+]1ccc(C=O)cc1	PADEL_KR2946
PADEL_KR2947	[O-][NH]=N	PADEL_KR2947
PADEL_KR2948	[O-][NH]=O	PADEL_KR2948
PADEL_KR2949	[OH]	PADEL_KR2949
PADEL_KR2950	Br	PADEL_KR2950
PADEL_KR2951	Brc1c[nH]nc1C=O	PADEL_KR2951
PADEL_KR2952	Brc1cc(Br)c2cccnc2c1	PADEL_KR2952
PADEL_KR2953	Brc1cc(Br)cc(Br)c1	PADEL_KR2953
PADEL_KR2954	Brc1cc2OCOc2cc1C=NNC=O	PADEL_KR2954
PADEL_KR2955	Brc1ccc(C=N)cc1	PADEL_KR2955
PADEL_KR2956	Brc1ccc(C=N)s1	PADEL_KR2956
PADEL_KR2957	Brc1ccc(C=NNC=O)cc1	PADEL_KR2957
PADEL_KR2958	Brc1ccc(C=NOC=O)cc1	PADEL_KR2958
PADEL_KR2959	Brc1ccc(C=O)c(C=O)c1	PADEL_KR2959
PADEL_KR2960	Brc1ccc(C=O)cc1	PADEL_KR2960
PADEL_KR2961	Brc1ccc(C=O)o1	PADEL_KR2961
PADEL_KR2962	Brc1ccc(cc1)N2C(=O)CCC2=O	PADEL_KR2962
PADEL_KR2963	Brc1ccc(cc1)S(=O)=O	PADEL_KR2963
PADEL_KR2964	Brc1ccc(NC=O)cc1	PADEL_KR2964
PADEL_KR2965	Brc1ccc(NS(=O)=O)cc1	PADEL_KR2965
PADEL_KR2966	Brc1cccc(Br)c1	PADEL_KR2966
PADEL_KR2967	Brc1cccc(C=O)c1	PADEL_KR2967
PADEL_KR2968	Brc1cccc2ccccc12	PADEL_KR2968
PADEL_KR2969	Brc1ccccc1	PADEL_KR2969
PADEL_KR2970	Brc1ccccc1C=O	PADEL_KR2970
PADEL_KR2971	Brc1ccccc1NC=O	PADEL_KR2971
PADEL_KR2972	Brc1cccnc1	PADEL_KR2972
PADEL_KR2973	Brc1ccco1	PADEL_KR2973
PADEL_KR2974	BrCCC=O	PADEL_KR2974
PADEL_KR2975	C	PADEL_KR2975
PADEL_KR2976	C#C	PADEL_KR2976
PADEL_KR2977	C#N	PADEL_KR2977
PADEL_KR2978	C(#Cc1ccccc1)c2ccccc2	PADEL_KR2978
PADEL_KR2979	C(c1ccccc1)c2ccccc2	PADEL_KR2979
PADEL_KR2980	C(c1nnn[nH]1)c2ccccc2	PADEL_KR2980
PADEL_KR2981	C(Cc1ccccc1)c2ccccc2	PADEL_KR2981
PADEL_KR2982	C(Cc1ccncc1)S(c2ccccc2)	PADEL_KR2982
PADEL_KR2983	C(NCc1ccccc1)c2ccccc2	PADEL_KR2983
PADEL_KR2984	C[N+](=O)[O-]	PADEL_KR2984
PADEL_KR2985	C[NH](C)C	PADEL_KR2985
PADEL_KR2986	C=C	PADEL_KR2986
PADEL_KR2987	C=C(C#N)C#N	PADEL_KR2987
PADEL_KR2988	C=C(NC=O)C=O	PADEL_KR2988
PADEL_KR2989	C=c1[nH]c(=O)c(=C)[nH]c1=O	PADEL_KR2989
PADEL_KR2990	C=C1C(=O)c2ccccc2C1=O	PADEL_KR2990
PADEL_KR2991	C=C1C(=O)N(N=C1c2ccccc2)c3ccccc3	PADEL_KR2991
PADEL_KR2992	C=C1C(=O)NC(=O)N(C1=O)c2cccc3ccccc23	PADEL_KR2992
PADEL_KR2993	C=C1C(=O)NC(=O)NC1=O	PADEL_KR2993
PADEL_KR2994	C=C1C(=O)OCOC1=O	PADEL_KR2994
PADEL_KR2995	C=C1C=NN(C1=O)c2ccccc2	PADEL_KR2995
PADEL_KR2996	C=C1CNCC(=C)C1=O	PADEL_KR2996
PADEL_KR2997	C=C1N=C(OC1=O)c2ccccc2	PADEL_KR2997
PADEL_KR2998	C=C1Nc2ccccc2C=C1	PADEL_KR2998
PADEL_KR2999	C=C1OC(=O)c2c1cc[nH]c2=O	PADEL_KR2999
PADEL_KR3000	C=C1SC(=N)NC1=O	PADEL_KR3000
PADEL_KR3001	C=C1SC(=O)NC1=O	PADEL_KR3001
PADEL_KR3002	C=C1SC(=S)N(C1=O)c2ccccc2	PADEL_KR3002
PADEL_KR3003	C=C1SC(=S)NC1=O	PADEL_KR3003
PADEL_KR3004	C=CC(=O)NC=S	PADEL_KR3004
PADEL_KR3005	C=CC(=O)NNC=O	PADEL_KR3005
PADEL_KR3006	C=CC=C1SC(=S)N(C1=O)c2ccccc2	PADEL_KR3006
PADEL_KR3007	C=CC=C1SC(=S)NC1=O	PADEL_KR3007
PADEL_KR3008	C=CC=N	PADEL_KR3008
PADEL_KR3009	C=CC=NNC=O	PADEL_KR3009
PADEL_KR3010	C=CC=O	PADEL_KR3010
PADEL_KR3011	C=CC1CN2CCC1CC2	PADEL_KR3011
PADEL_KR3012	C=CCNC=O	PADEL_KR3012
PADEL_KR3013	C=N	PADEL_KR3013
PADEL_KR3014	C=NC=NNC=O	PADEL_KR3014
PADEL_KR3015	C=NCCCCCCN=C	PADEL_KR3015
PADEL_KR3016	C=NCCN=C	PADEL_KR3016
PADEL_KR3017	C=NCCNC=O	PADEL_KR3017
PADEL_KR3018	C=NN=C	PADEL_KR3018
PADEL_KR3019	C=NNC(=O)C(=O)NN=C	PADEL_KR3019
PADEL_KR3020	C=NNC(=O)CC(=O)NN=C	PADEL_KR3020
PADEL_KR3021	C=NNC(=O)CNC=O	PADEL_KR3021
PADEL_KR3022	C=NNC=O	PADEL_KR3022
PADEL_KR3023	C=NNS(=O)=O	PADEL_KR3023
PADEL_KR3024	C=NOC=O	PADEL_KR3024
PADEL_KR3025	C=O	PADEL_KR3025
PADEL_KR3026	c1[nH]c2ccccc2[nH+]1	PADEL_KR3026
PADEL_KR3027	c1[nH]c2ccccc2c1c3ccccc3	PADEL_KR3027
PADEL_KR3028	c1[nH+]c2c(ccc3ccccc23)s1	PADEL_KR3028
PADEL_KR3029	c1[nH+]c2ccccc2o1	PADEL_KR3029
PADEL_KR3030	c1[nH+]c2ccccc2s1	PADEL_KR3030
PADEL_KR3031	C1C(N(N=C1c2ccccc2)c3ccccc3)c4ccccc4	PADEL_KR3031
PADEL_KR3032	c1c(nc2ccccn12)c3ccccc3	PADEL_KR3032
PADEL_KR3033	C1C(NN=C1c2ccccc2)c3ccccc3	PADEL_KR3033
PADEL_KR3034	c1c[nH]cn1	PADEL_KR3034
PADEL_KR3035	c1c[nH+]on1	PADEL_KR3035
PADEL_KR3036	C1C=NN(C1c2ccccc2)c3ccccc3	PADEL_KR3036
PADEL_KR3037	C1C=NNC1(c2ccccc2)c3ccccc3	PADEL_KR3037
PADEL_KR3038	C1C2CC3CC1CC(C2)(C3)c4ccccc4	PADEL_KR3038
PADEL_KR3039	C1C2CC3CC1CC(C2)(C3)c4cscn4	PADEL_KR3039
PADEL_KR3040	C1C2CC3CC1CC(C2)C3	PADEL_KR3040
PADEL_KR3041	C1C2CC3CC1CC(C2)CC3	PADEL_KR3041
PADEL_KR3042	C1C2CCCCC12	PADEL_KR3042
PADEL_KR3043	C1c2ccccc2-c3ccccc13	PADEL_KR3043
PADEL_KR3044	c1c2ccccc2n3cnc4ccccc4c13	PADEL_KR3044
PADEL_KR3045	C1c2ccccc2Oc3ccccc13	PADEL_KR3045
PADEL_KR3046	c1cc([nH]n1)c2ccccc2	PADEL_KR3046
PADEL_KR3047	C1CC(=NN1)c2ccccc2	PADEL_KR3047
PADEL_KR3048	C1CC(=NN1c2ccccc2)c3ccccc3	PADEL_KR3048
PADEL_KR3049	C1CC(CCN1)c2ccccc2	PADEL_KR3049
PADEL_KR3050	C1CC(CN1)c2ccccc2	PADEL_KR3050
PADEL_KR3051	c1cc(cs1)c2ccccc2	PADEL_KR3051
PADEL_KR3052	c1cc(n[nH]1)c2ccccc2	PADEL_KR3052
PADEL_KR3053	c1cc[n+]2cccnc2c1	PADEL_KR3053
PADEL_KR3054	c1cc[nH]c1	PADEL_KR3054
PADEL_KR3055	c1cc[nH+]cc1	PADEL_KR3055
PADEL_KR3056	C1CC=CC=C1	PADEL_KR3056
PADEL_KR3057	C1CC=CCN1	PADEL_KR3057
PADEL_KR3058	C1CC1	PADEL_KR3058
PADEL_KR3059	C1CC1(c2ccccc2)c3ccccc3	PADEL_KR3059
PADEL_KR3060	C1CC12CCC2	PADEL_KR3060
PADEL_KR3061	C1CC1C2CC2c3ccco3	PADEL_KR3061
PADEL_KR3062	C1CC1c2ccccc2	PADEL_KR3062
PADEL_KR3063	C1Cc2[nH]cnc2C(N1)c3ccccc3	PADEL_KR3063
PADEL_KR3064	C1Cc2c([nH]c3ccccc23)C(N1)c4ccccc4	PADEL_KR3064
PADEL_KR3065	C1Cc2c([nH]c3ccccc23)-c4cnn(c14)c5ccccc5	PADEL_KR3065
PADEL_KR3066	C1Cc2c(CN1)[nH]c3ccccc23	PADEL_KR3066
PADEL_KR3067	c1cc2c(n[nH]c(c3ccccc3)c2c1)c4ccccc4	PADEL_KR3067
PADEL_KR3068	c1cc2c[nH+]ccn2c1	PADEL_KR3068
PADEL_KR3069	C1CC2c3ccccc3C1c4ccccc24	PADEL_KR3069
PADEL_KR3070	C1CC2CC1C=C2	PADEL_KR3070
PADEL_KR3071	C1Cc2cc3CCCCc3nc2C1	PADEL_KR3071
PADEL_KR3072	C1Cc2cc3ccccc3nc2N1	PADEL_KR3072
PADEL_KR3073	C1Cc2cc3ccccc3nc2N1c4ccccc4	PADEL_KR3073
PADEL_KR3074	C1CC2CCC1C2	PADEL_KR3074
PADEL_KR3075	c1cc2ccc3ccccc3c2o1	PADEL_KR3075
PADEL_KR3076	C1CC2CCCC1N2	PADEL_KR3076
PADEL_KR3077	C1Cc2cccc3cccc1c23	PADEL_KR3077
PADEL_KR3078	c1cc2ccccc2[nH]1	PADEL_KR3078
PADEL_KR3079	C1Cc2ccccc2C(N1)c3ccccc3	PADEL_KR3079
PADEL_KR3080	C1Cc2ccccc2C3=NNC(C13)c4ccccc4	PADEL_KR3080
PADEL_KR3081	C1Cc2ccccc2CN1	PADEL_KR3081
PADEL_KR3082	C1Cc2ccccc2N1	PADEL_KR3082
PADEL_KR3083	c1cc2ccccc2n1c3ccccc3	PADEL_KR3083
PADEL_KR3084	C1Cc2ccccc2Nc3ccccc13	PADEL_KR3084
PADEL_KR3085	c1cc2ccccc2o1	PADEL_KR3085
PADEL_KR3086	c1cc2ccccc2s1	PADEL_KR3086
PADEL_KR3087	c1cc2cccnc2s1	PADEL_KR3087
PADEL_KR3088	C1CC2CNCCN2C1	PADEL_KR3088
PADEL_KR3089	c1cc2cncnc2s1	PADEL_KR3089
PADEL_KR3090	C1CC2Nc3ccccc3C2CN1	PADEL_KR3090
PADEL_KR3091	c1cc2nc3ccccc3nc2n1c4ccccc4	PADEL_KR3091
PADEL_KR3092	C1Cc2nccn2C1	PADEL_KR3092
PADEL_KR3093	C1CC2NCCn3c2c(C1)c4ccccc34	PADEL_KR3093
PADEL_KR3094	C1Cc2sc3ncncc3c2C1	PADEL_KR3094
PADEL_KR3095	C1CCC(C1)c2nnn[nH]2	PADEL_KR3095
PADEL_KR3096	c1ccc(cc1)C(c2ccccc2)c3ccccc3	PADEL_KR3096
PADEL_KR3097	c1ccc(cc1)C2(c3ccccc3-c4ccccc42)c5ccccc5	PADEL_KR3097
PADEL_KR3098	c1ccc(cc1)c2cc(nc(n2)c3ccccc3)c4ccccc4	PADEL_KR3098
PADEL_KR3099	c1ccc(cc1)c2cc(ncn2)c3ccccc3	PADEL_KR3099
PADEL_KR3100	C1CCC(CC1)c2ccc3[nH]c4CCCCc4c3c2	PADEL_KR3100
PADEL_KR3101	c1ccc(cc1)c2ccc3c(ccc4ccccc43)n2	PADEL_KR3101
PADEL_KR3102	c1ccc(cc1)c2ccc3ccccc3n2	PADEL_KR3102
PADEL_KR3103	c1ccc(cc1)c2cccc(n2)c3ccccc3	PADEL_KR3103
PADEL_KR3104	C1CCC(CC1)c2ccccc2	PADEL_KR3104
PADEL_KR3105	c1ccc(cc1)c2ccccn2	PADEL_KR3105
PADEL_KR3106	c1ccc(cc1)c2ccnc(n2)c3ccccc3	PADEL_KR3106
PADEL_KR3107	c1ccc(cc1)c2ccncn2	PADEL_KR3107
PADEL_KR3108	c1ccc(cc1)c2cnc3ccccc3n2	PADEL_KR3108
PADEL_KR3109	c1ccc(cc1)c2n[nH]c(n2)c3ccccc3	PADEL_KR3109
PADEL_KR3110	c1ccc(cc1)c2nc(c3ccccc3)c4ccccc4n2	PADEL_KR3110
PADEL_KR3111	c1ccc(cc1)c2nc3ccccc3[nH]2	PADEL_KR3111
PADEL_KR3112	c1ccc(cc1)c2nc3ccccc3nc2c4ccccc4	PADEL_KR3112
PADEL_KR3113	c1ccc(cc1)c2nc3ccccc3o2	PADEL_KR3113
PADEL_KR3114	c1ccc(cc1)c2nc3ccccc3s2	PADEL_KR3114
PADEL_KR3115	c1ccc(cc1)c2ncccn2	PADEL_KR3115
PADEL_KR3116	c1ccc(cc1)c2ncncn2	PADEL_KR3116
PADEL_KR3117	C1CCC(CC1)c2nnn[nH]2	PADEL_KR3117
PADEL_KR3118	C1CCC(CC1)c2nnnn2c3ccccc3	PADEL_KR3118
PADEL_KR3119	c1ccc(cc1)n2nc3ccccc3n2	PADEL_KR3119
PADEL_KR3120	C1CCC=CC1	PADEL_KR3120
PADEL_KR3121	C1CCC1	PADEL_KR3121
PADEL_KR3122	c1ccc2[nH]nnc2c1	PADEL_KR3122
PADEL_KR3123	c1ccc2[nH+]c3ccccc3nc2c1	PADEL_KR3123
PADEL_KR3124	c1ccc2[nH+]cccc2c1	PADEL_KR3124
PADEL_KR3125	c1ccc2c(c1)[nH]c3cc4ccccc4nc32	PADEL_KR3125
PADEL_KR3126	C1CCc2c(C1)[nH]c3ccc(cc23)c4ccccc4	PADEL_KR3126
PADEL_KR3127	C1CCc2c(C1)[nH]c3ccccc23	PADEL_KR3127
PADEL_KR3128	c1ccc2c(c1)[nH]c3ccccc32	PADEL_KR3128
PADEL_KR3129	c1ccc2c(c1)[nH]c3ncnnc23	PADEL_KR3129
PADEL_KR3130	C1CCc2c(C1)nc3ccccn23	PADEL_KR3130
PADEL_KR3131	c1ccc2c(c1)oc3ccccc32	PADEL_KR3131
PADEL_KR3132	C1CCc2c(C1)sc3ncncc23	PADEL_KR3132
PADEL_KR3133	C1CCC2C(NCCC2C1)c3ccccc3	PADEL_KR3133
PADEL_KR3134	c1ccc2c[nH+]ccc2c1	PADEL_KR3134
PADEL_KR3135	c1ccc2c3[nH]c4ccccc4c3[nH]c2c1	PADEL_KR3135
PADEL_KR3136	c1ccc2C3c4ccccc4C(c2c1)c5ccccc35	PADEL_KR3136
PADEL_KR3137	c1ccc2cc3ccccc3cc2c1	PADEL_KR3137
PADEL_KR3138	c1ccc2cc3ncccc3cc2c1	PADEL_KR3138
PADEL_KR3139	c1ccc2ccccc2c1	PADEL_KR3139
PADEL_KR3140	c1ccc2n[nH]nc2c1	PADEL_KR3140
PADEL_KR3141	c1ccc2nc3ccccc3cc2c1	PADEL_KR3141
PADEL_KR3142	c1ccc2nc3ccccc3nc2c1	PADEL_KR3142
PADEL_KR3143	c1ccc2ncccc2c1	PADEL_KR3143
PADEL_KR3144	c1ccc2nccnc2c1	PADEL_KR3144
PADEL_KR3145	c1ccc2ncncc2c1	PADEL_KR3145
PADEL_KR3146	c1ccc2nonc2c1	PADEL_KR3146
PADEL_KR3147	c1ccc2nsnc2c1	PADEL_KR3147
PADEL_KR3148	C1CCc2sccc2C1	PADEL_KR3148
PADEL_KR3149	C1CCCC1	PADEL_KR3149
PADEL_KR3150	C1CCCCC1	PADEL_KR3150
PADEL_KR3151	C1CCCCCC1	PADEL_KR3151
PADEL_KR3152	C1CCCCCCC1	PADEL_KR3152
PADEL_KR3153	C1CCCNCC1	PADEL_KR3153
PADEL_KR3154	c1ccn(c1)c2ccccc2	PADEL_KR3154
PADEL_KR3155	C1CCN(CC1)c2ncncn2	PADEL_KR3155
PADEL_KR3156	C1CCNC1	PADEL_KR3156
PADEL_KR3157	C1CCNCC1	PADEL_KR3157
PADEL_KR3158	c1ccnnc1	PADEL_KR3158
PADEL_KR3159	c1ccoc1	PADEL_KR3159
PADEL_KR3160	C1CCOCC1	PADEL_KR3160
PADEL_KR3161	c1ccsc1	PADEL_KR3161
PADEL_KR3162	C1CN(C(N1c2ccccc2)c3ccccc3)c4ccccc4	PADEL_KR3162
PADEL_KR3163	C1CN(CCN1)c2ccccc2	PADEL_KR3163
PADEL_KR3164	C1CN(CCN1)c2ccccn2	PADEL_KR3164
PADEL_KR3165	C1CN(CCO1)c2ccccc2	PADEL_KR3165
PADEL_KR3166	C1CN(CCO1)c2ncnc(n2)N3CCOCC3	PADEL_KR3166
PADEL_KR3167	C1CN(CCO1)c2ncncn2	PADEL_KR3167
PADEL_KR3168	c1cn(nc1c2ccccc2)c3ccccc3	PADEL_KR3168
PADEL_KR3169	c1cn[nH]c1	PADEL_KR3169
PADEL_KR3170	c1cn2c(n1)[nH]c3ccccc32	PADEL_KR3170
PADEL_KR3171	C1CN2CCC1CC2	PADEL_KR3171
PADEL_KR3172	C1Cn2cccc2C=[NH+]1	PADEL_KR3172
PADEL_KR3173	C1Cn2cccc2C=N1	PADEL_KR3173
PADEL_KR3174	C1Cn2cccc2CN1	PADEL_KR3174
PADEL_KR3175	c1cn2ccccc2n1	PADEL_KR3175
PADEL_KR3176	C1CNC(N1)c2ccccc2	PADEL_KR3176
PADEL_KR3177	C1CNc2ccccc2C1	PADEL_KR3177
PADEL_KR3178	c1cnc2nonc2n1	PADEL_KR3178
PADEL_KR3179	C1CNCCN1	PADEL_KR3179
PADEL_KR3180	c1cncnc1	PADEL_KR3180
PADEL_KR3181	c1cnn(c1)c2ccccc2	PADEL_KR3181
PADEL_KR3182	c1cnoc1	PADEL_KR3182
PADEL_KR3183	c1cnon1	PADEL_KR3183
PADEL_KR3184	c1coc(c1)c2ccccc2	PADEL_KR3184
PADEL_KR3185	C1COC(C1)n2cnc3cncnc23	PADEL_KR3185
PADEL_KR3186	C1COC(N1)c2ccccc2	PADEL_KR3186
PADEL_KR3187	C1COC=CO1	PADEL_KR3187
PADEL_KR3188	C1COC2(CCCCC2)O1	PADEL_KR3188
PADEL_KR3189	C1COC2C(C1)COc3ccccc23	PADEL_KR3189
PADEL_KR3190	C1COc2ccccc2O1	PADEL_KR3190
PADEL_KR3191	C1COCCN1	PADEL_KR3191
PADEL_KR3192	C1COCCO1	PADEL_KR3192
PADEL_KR3193	C1COCCOCCNCCOCCOCCN1	PADEL_KR3193
PADEL_KR3194	C1COCCOCCOCCOCCOCCN1	PADEL_KR3194
PADEL_KR3195	c1cocn1	PADEL_KR3195
PADEL_KR3196	C1COCO1	PADEL_KR3196
PADEL_KR3197	c1csc(c1)c2ccccc2	PADEL_KR3197
PADEL_KR3198	C1CSC(N1)c2ccccc2	PADEL_KR3198
PADEL_KR3199	c1csc[nH+]1	PADEL_KR3199
PADEL_KR3200	c1cscn1	PADEL_KR3200
PADEL_KR3201	c1n[nH]c2cccn[n+]12	PADEL_KR3201
PADEL_KR3202	c1n[nH+]c[nH]1	PADEL_KR3202
PADEL_KR3203	c1nc(cs1)c2ccccc2	PADEL_KR3203
PADEL_KR3204	c1nc(oc1c2ccccc2)c3ccccc3	PADEL_KR3204
PADEL_KR3205	c1nc[nH]n1	PADEL_KR3205
PADEL_KR3206	c1nc2ccccc2[nH]1	PADEL_KR3206
PADEL_KR3207	c1nc2ccccc2o1	PADEL_KR3207
PADEL_KR3208	c1nc2ccccc2s1	PADEL_KR3208
PADEL_KR3209	c1nc2cnccc2[nH]1	PADEL_KR3209
PADEL_KR3210	c1nc2cncnc2[nH]1	PADEL_KR3210
PADEL_KR3211	c1nc2nc(cc(c3ccccc3)n2n1)c4ccccc4	PADEL_KR3211
PADEL_KR3212	c1nc2ncccn2n1	PADEL_KR3212
PADEL_KR3213	c1nc2ncncc2[nH]1	PADEL_KR3213
PADEL_KR3214	c1ncc(s1)c2ccccc2	PADEL_KR3214
PADEL_KR3215	c1ncncn1	PADEL_KR3215
PADEL_KR3216	c1nnc[nH]1	PADEL_KR3216
PADEL_KR3217	c1nncn1c2ccccc2	PADEL_KR3217
PADEL_KR3218	c1nnco1	PADEL_KR3218
PADEL_KR3219	c1nncs1	PADEL_KR3219
PADEL_KR3220	c1nnn[nH]1	PADEL_KR3220
PADEL_KR3221	c1nnnn1c2ccccc2	PADEL_KR3221
PADEL_KR3222	C1Oc2ccccc2O1	PADEL_KR3222
PADEL_KR3223	CBr	PADEL_KR3223
PADEL_KR3224	CC	PADEL_KR3224
PADEL_KR3225	CC#C	PADEL_KR3225
PADEL_KR3226	CC#CC(O)(c1ccccc1)c2ccccc2	PADEL_KR3226
PADEL_KR3227	CC#CCCO	PADEL_KR3227
PADEL_KR3228	CC(=C)C(=O)N	PADEL_KR3228
PADEL_KR3229	CC(=N)C	PADEL_KR3229
PADEL_KR3230	CC(=N)CC=O	PADEL_KR3230
PADEL_KR3231	CC(=NN)C	PADEL_KR3231
PADEL_KR3232	CC(=NNC(=O)c1ccccc1)c2ccccc2	PADEL_KR3232
PADEL_KR3233	CC(=NNC(=O)c1ccccc1O)c2ccccc2	PADEL_KR3233
PADEL_KR3234	CC(=NNC(=O)CO)C	PADEL_KR3234
PADEL_KR3235	CC(=NNC(=O)CO)C=C	PADEL_KR3235
PADEL_KR3236	CC(=NNC(=O)CO)C=Cc1ccco1	PADEL_KR3236
PADEL_KR3237	CC(=NNC(=O)CO)c1ccc(Br)s1	PADEL_KR3237
PADEL_KR3238	CC(=NNC(=O)CO)c1cccs1	PADEL_KR3238
PADEL_KR3239	CC(=NNC=O)C	PADEL_KR3239
PADEL_KR3240	CC(=NNC=O)C(=O)O	PADEL_KR3240
PADEL_KR3241	CC(=NNC=O)C=C	PADEL_KR3241
PADEL_KR3242	CC(=NNC=O)C=Cc1ccccc1	PADEL_KR3242
PADEL_KR3243	CC(=NNC=O)c1cc(O)ccc1O	PADEL_KR3243
PADEL_KR3244	CC(=NNC=O)C1CC1	PADEL_KR3244
PADEL_KR3245	CC(=NNC=O)c1cc2ccc(O)cc2oc1=O	PADEL_KR3245
PADEL_KR3246	CC(=NNC=O)c1ccc(Br)cc1	PADEL_KR3246
PADEL_KR3247	CC(=NNC=O)c1ccc(cc1)[N+](=O)[O-]	PADEL_KR3247
PADEL_KR3248	CC(=NNC=O)c1ccc(cc1)c2ccccc2	PADEL_KR3248
PADEL_KR3249	CC(=NNC=O)c1ccc(Cl)s1	PADEL_KR3249
PADEL_KR3250	CC(=NNC=O)c1ccc(F)cc1	PADEL_KR3250
PADEL_KR3251	CC(=NNC=O)c1ccc(N)cc1	PADEL_KR3251
PADEL_KR3252	CC(=NNC=O)c1ccc(O)cc1	PADEL_KR3252
PADEL_KR3253	CC(=NNC=O)c1cccc(c1)[N+](=O)[O-]	PADEL_KR3253
PADEL_KR3254	CC(=NNC=O)c1cccc(N)c1	PADEL_KR3254
PADEL_KR3255	CC(=NNC=O)c1ccccc1	PADEL_KR3255
PADEL_KR3256	CC(=NNC=O)c1ccccc1O	PADEL_KR3256
PADEL_KR3257	CC(=NNC=O)c1ccco1	PADEL_KR3257
PADEL_KR3258	CC(=NNC=O)c1cccs1	PADEL_KR3258
PADEL_KR3259	CC(=NNC=O)CC(=O)N	PADEL_KR3259
PADEL_KR3260	CC(=NNC=O)CCC=C	PADEL_KR3260
PADEL_KR3261	CC(=NNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])c2ccccc2	PADEL_KR3261
PADEL_KR3262	CC(=NNc1ccccc1)c2ccccc2	PADEL_KR3262
PADEL_KR3263	CC(=NNc1ccccc1)CC=O	PADEL_KR3263
PADEL_KR3264	CC(=NO)c1ccccc1	PADEL_KR3264
PADEL_KR3265	CC(=NOC(=O)N)C	PADEL_KR3265
PADEL_KR3266	CC(=NOC=O)C(C)(C)C	PADEL_KR3266
PADEL_KR3267	CC(=NOC=O)c1ccccc1	PADEL_KR3267
PADEL_KR3268	CC(=O)C	PADEL_KR3268
PADEL_KR3269	CC(=O)C1(C(C=O)C(C=O)C2c3ccccc31)c4ccccc24	PADEL_KR3269
PADEL_KR3270	CC(=O)C1(CC2CC3CC(C2)C1)C3	PADEL_KR3270
PADEL_KR3271	CC(=O)c1c(C)[nH]c2ccc(O)cc12	PADEL_KR3271
PADEL_KR3272	CC(=O)c1c(C)[nH]c2ccccc12	PADEL_KR3272
PADEL_KR3273	CC(=O)c1c(C)cc(C)[nH]c1=O	PADEL_KR3273
PADEL_KR3274	CC(=O)c1c(O)cc(C)oc1=O	PADEL_KR3274
PADEL_KR3275	CC(=O)c1ccc(Br)cc1	PADEL_KR3275
PADEL_KR3276	CC(=O)c1ccc(C)cc1	PADEL_KR3276
PADEL_KR3277	CC(=O)c1ccc(cc1)c2ccccc2	PADEL_KR3277
PADEL_KR3278	CC(=O)c1ccc(Cl)c(Cl)c1	PADEL_KR3278
PADEL_KR3279	CC(=O)c1ccc(Cl)cc1	PADEL_KR3279
PADEL_KR3280	CC(=O)c1ccc(N)cc1	PADEL_KR3280
PADEL_KR3281	CC(=O)c1ccc(O)cc1	PADEL_KR3281
PADEL_KR3282	CC(=O)c1cccc(c1)[N+](=O)[O-]	PADEL_KR3282
PADEL_KR3283	CC(=O)c1ccccc1	PADEL_KR3283
PADEL_KR3284	CC(=O)c1ccccc1C(=O)C	PADEL_KR3284
PADEL_KR3285	CC(=O)c1ccccc1O	PADEL_KR3285
PADEL_KR3286	CC(=O)c1ccncc1	PADEL_KR3286
PADEL_KR3287	CC(=O)CC(=NNC=O)C	PADEL_KR3287
PADEL_KR3288	CC(=O)CC(=O)C	PADEL_KR3288
PADEL_KR3289	CC(=O)CC(=O)N	PADEL_KR3289
PADEL_KR3290	CC(=O)CC(C)(C)S(=O)=O	PADEL_KR3290
PADEL_KR3291	CC(=O)CC=O	PADEL_KR3291
PADEL_KR3292	CC(=O)CCS(=O)=O	PADEL_KR3292
PADEL_KR3293	CC(=O)CO	PADEL_KR3293
PADEL_KR3294	CC(=O)CS(=O)=O	PADEL_KR3294
PADEL_KR3295	CC(=O)N	PADEL_KR3295
PADEL_KR3296	CC(=O)n1ccc2ccccc12	PADEL_KR3296
PADEL_KR3297	CC(=O)N1CCOCC1	PADEL_KR3297
PADEL_KR3298	CC(=O)NC(=C)C(=O)N	PADEL_KR3298
PADEL_KR3299	CC(=O)NC(=Cc1ccccc1)C(=O)N	PADEL_KR3299
PADEL_KR3300	CC(=O)NC(N)C(Cl)(Cl)Cl	PADEL_KR3300
PADEL_KR3301	CC(=O)NC(NC(=S)N)C(Cl)(Cl)Cl	PADEL_KR3301
PADEL_KR3302	CC(=O)NCC(=O)N	PADEL_KR3302
PADEL_KR3303	CC(=O)NN	PADEL_KR3303
PADEL_KR3304	CC(=O)NN=C	PADEL_KR3304
PADEL_KR3305	CC(=O)NN=C(C)c1ccccc1	PADEL_KR3305
PADEL_KR3306	CC(=O)NN=C(C=O)c1cccc(Br)c1	PADEL_KR3306
PADEL_KR3307	CC(=O)NN=C(C=O)c1cccc(c1)[N+](=O)[O-]	PADEL_KR3307
PADEL_KR3308	CC(=O)NN=C1CCCc2c1non2=O	PADEL_KR3308
PADEL_KR3309	CC(=O)NN=Cc1c(Cl)cccc1Cl	PADEL_KR3309
PADEL_KR3310	CC(=O)NN=Cc1c(O)ccc2ccccc12	PADEL_KR3310
PADEL_KR3311	CC(=O)NN=Cc1c[nH]c2ccccc12	PADEL_KR3311
PADEL_KR3312	CC(=O)NN=Cc1cc(ccc1O)[N+](=O)[O-]	PADEL_KR3312
PADEL_KR3313	CC(=O)NN=Cc1cc(N=Nc2ccccc2)ccc1O	PADEL_KR3313
PADEL_KR3314	CC(=O)NN=Cc1cc2ccccc2nc1Cl	PADEL_KR3314
PADEL_KR3315	CC(=O)NN=Cc1cc2OCOc2cc1[N+](=O)[O-]	PADEL_KR3315
PADEL_KR3316	CC(=O)NN=Cc1ccc(Br)cc1	PADEL_KR3316
PADEL_KR3317	CC(=O)NN=Cc1ccc(cc1)[N+](=O)[O-]	PADEL_KR3317
PADEL_KR3318	CC(=O)NN=Cc1ccc(Cl)cc1	PADEL_KR3318
PADEL_KR3319	CC(=O)NN=Cc1ccc2OCOc2c1	PADEL_KR3319
PADEL_KR3320	CC(=O)NN=Cc1cccc(c1)[N+](=O)[O-]	PADEL_KR3320
PADEL_KR3321	CC(=O)NN=Cc1ccccc1	PADEL_KR3321
PADEL_KR3322	CC(=O)NN=Cc1ccccc1O	PADEL_KR3322
PADEL_KR3323	CC(=O)NN=Cc1ccco1	PADEL_KR3323
PADEL_KR3324	CC(=O)NN=Cc1cccs1	PADEL_KR3324
PADEL_KR3325	CC(=O)NNC=O	PADEL_KR3325
PADEL_KR3326	CC(=O)NO	PADEL_KR3326
PADEL_KR3327	CC(=O)NS(=O)=O	PADEL_KR3327
PADEL_KR3328	CC(=O)O	PADEL_KR3328
PADEL_KR3329	CC(=O)O[Na]	PADEL_KR3329
PADEL_KR3330	CC(=O)OC(=N)c1ccccc1	PADEL_KR3330
PADEL_KR3331	CC(=O)OCC=O	PADEL_KR3331
PADEL_KR3332	CC(=O)OCCNC=O	PADEL_KR3332
PADEL_KR3333	CC(Br)(Br)Br	PADEL_KR3333
PADEL_KR3334	CC(Br)C(=O)N	PADEL_KR3334
PADEL_KR3335	CC(C(C=O)C(C=O)C(C)c1ccccc1)c2ccccc2	PADEL_KR3335
PADEL_KR3336	CC(C)(C)C	PADEL_KR3336
PADEL_KR3337	CC(C)(C)C(=O)N	PADEL_KR3337
PADEL_KR3338	CC(C)(C)C(=O)NC(NC(=S)N)C(Cl)(Cl)Cl	PADEL_KR3338
PADEL_KR3339	CC(C)(C)C=O	PADEL_KR3339
PADEL_KR3340	CC(C)(C)c1cc(Br)cc(C=N)c1O	PADEL_KR3340
PADEL_KR3341	CC(C)(C)c1cc(C=N)cc(c1O)C(C)(C)C	PADEL_KR3341
PADEL_KR3342	CC(C)(C)c1cc(C=O)cc(c1)C(C)(C)C	PADEL_KR3342
PADEL_KR3343	CC(C)(C)c1ccc(C=O)cc1	PADEL_KR3343
PADEL_KR3344	CC(C)(C)c1ccc(cc1)S(=O)=O	PADEL_KR3344
PADEL_KR3345	CC(C)(C)c1ccc(O)c(c1)C(C)(C)C	PADEL_KR3345
PADEL_KR3346	CC(C)(C)c1ccc(O)cc1	PADEL_KR3346
PADEL_KR3347	CC(C)(C)c1cccc(c1)C(C)(C)C	PADEL_KR3347
PADEL_KR3348	CC(C)(C)c1cccc(c1O)C(C)(C)C	PADEL_KR3348
PADEL_KR3349	CC(C)(C)c1ccccc1	PADEL_KR3349
PADEL_KR3350	CC(C)(C)c1ncccc1O	PADEL_KR3350
PADEL_KR3351	CC(C)(C)CC=C	PADEL_KR3351
PADEL_KR3352	CC(C)(C)CC=Cc1ccc(Cl)cc1Cl	PADEL_KR3352
PADEL_KR3353	CC(C)(C)N	PADEL_KR3353
PADEL_KR3354	CC(C)(C)NC(NC=O)C(Cl)(Cl)Cl	PADEL_KR3354
PADEL_KR3355	CC(C)(C)NC=O	PADEL_KR3355
PADEL_KR3356	CC(C)(C)NCC(=O)N	PADEL_KR3356
PADEL_KR3357	CC(C)(C)NCC(O)CO	PADEL_KR3357
PADEL_KR3358	CC(C)(C)NS(=O)(=O)N	PADEL_KR3358
PADEL_KR3359	CC(C)(C)NS(=O)=O	PADEL_KR3359
PADEL_KR3360	CC(C)(C)O	PADEL_KR3360
PADEL_KR3361	CC(C)(C)OC=O	PADEL_KR3361
PADEL_KR3362	CC(C)(C)S	PADEL_KR3362
PADEL_KR3363	CC(C)(C)S(=O)=O	PADEL_KR3363
PADEL_KR3364	CC(C)(c1ccc(O)cc1)c2ccc(O)cc2	PADEL_KR3364
PADEL_KR3365	CC(C)(CCC(=O)N)C(=O)N	PADEL_KR3365
PADEL_KR3366	CC(C)(CCC=O)C=O	PADEL_KR3366
PADEL_KR3367	CC(C)(N)CO	PADEL_KR3367
PADEL_KR3368	CC(C)(O)C#C	PADEL_KR3368
PADEL_KR3369	CC(C)C	PADEL_KR3369
PADEL_KR3370	CC(C)C(=O)NC(NC(=S)N)C(Cl)(Cl)Cl	PADEL_KR3370
PADEL_KR3371	CC(C)C(N)C(=O)O	PADEL_KR3371
PADEL_KR3372	CC(C)C(NC(=S)SCC=O)C(=O)O	PADEL_KR3372
PADEL_KR3373	CC(C)C(NC=O)C(=O)O	PADEL_KR3373
PADEL_KR3374	CC(C)C(NS(=O)=O)C(=O)O	PADEL_KR3374
PADEL_KR3375	CC(C)C=O	PADEL_KR3375
PADEL_KR3376	CC(C)c1cc(C(C)C)c(S(=O)=O)c(c1)C(C)C	PADEL_KR3376
PADEL_KR3377	CC(C)c1cc(cc(c1)C(C)C)C(C)C	PADEL_KR3377
PADEL_KR3378	CC(C)c1ccc(C)c(O)c1	PADEL_KR3378
PADEL_KR3379	CC(C)c1ccc(C)cc1	PADEL_KR3379
PADEL_KR3380	CC(C)C1CCC(C)CC1O	PADEL_KR3380
PADEL_KR3381	CC(C)c1ccc(O)cc1	PADEL_KR3381
PADEL_KR3382	CC(C)c1ccccc1	PADEL_KR3382
PADEL_KR3383	CC(C)c1nnn[nH]1	PADEL_KR3383
PADEL_KR3384	CC(C)CC(=NNC=O)C	PADEL_KR3384
PADEL_KR3385	CC(C)CC(=O)N	PADEL_KR3385
PADEL_KR3386	CC(C)CC(=O)NC(NC(=S)N)C(Cl)(Cl)Cl	PADEL_KR3386
PADEL_KR3387	CC(C)CC(=O)O	PADEL_KR3387
PADEL_KR3388	CC(C)CC(C)(C)C	PADEL_KR3388
PADEL_KR3389	CC(C)CC(C)O	PADEL_KR3389
PADEL_KR3390	CC(C)CC=O	PADEL_KR3390
PADEL_KR3391	CC(C)Cc1ccc(cc1)C(C)C=O	PADEL_KR3391
PADEL_KR3392	CC(C)CCC(=O)O	PADEL_KR3392
PADEL_KR3393	CC(C)CCC=O	PADEL_KR3393
PADEL_KR3394	CC(C)CCCC(C)C	PADEL_KR3394
PADEL_KR3395	CC(C)CCO	PADEL_KR3395
PADEL_KR3396	CC(C)CN	PADEL_KR3396
PADEL_KR3397	CC(C)CN(CC(C)C)S(=O)=O	PADEL_KR3397
PADEL_KR3398	CC(C)CNC=O	PADEL_KR3398
PADEL_KR3399	CC(C)CO	PADEL_KR3399
PADEL_KR3400	CC(C)COC=O	PADEL_KR3400
PADEL_KR3401	CC(C)COP(=O)(N)OCC(C)C	PADEL_KR3401
PADEL_KR3402	CC(C)N	PADEL_KR3402
PADEL_KR3403	CC(C)N(C=O)C(C)C	PADEL_KR3403
PADEL_KR3404	CC(C)NC=O	PADEL_KR3404
PADEL_KR3405	CC(C)NCC(=O)N	PADEL_KR3405
PADEL_KR3406	CC(C)NCC(O)CO	PADEL_KR3406
PADEL_KR3407	CC(C)NS(=O)=O	PADEL_KR3407
PADEL_KR3408	CC(C)O	PADEL_KR3408
PADEL_KR3409	CC(C)OC(=O)N	PADEL_KR3409
PADEL_KR3410	CC(C)OC=O	PADEL_KR3410
PADEL_KR3411	CC(C)OP(=O)(N)OC(C)C	PADEL_KR3411
PADEL_KR3412	CC(CC=O)c1ccccc1	PADEL_KR3412
PADEL_KR3413	CC(Cl)(Cl)Cl	PADEL_KR3413
PADEL_KR3414	CC(N)C(=O)O	PADEL_KR3414
PADEL_KR3415	CC(N)c1ccccc1	PADEL_KR3415
PADEL_KR3416	CC(NC(=O)CO)C(=O)O	PADEL_KR3416
PADEL_KR3417	CC(NC(=O)OC(C)(C)C)C(=O)O	PADEL_KR3417
PADEL_KR3418	CC(NC=O)C(=O)N	PADEL_KR3418
PADEL_KR3419	CC(NC=O)C(=O)O	PADEL_KR3419
PADEL_KR3420	CC(NS(=O)=O)C(=O)O	PADEL_KR3420
PADEL_KR3421	CC(O)C(=O)NN	PADEL_KR3421
PADEL_KR3422	CC(O)C(=O)NN=C	PADEL_KR3422
PADEL_KR3423	CC(O)C(=O)NN=Cc1cc(ccc1O)[N+](=O)[O-]	PADEL_KR3423
PADEL_KR3424	CC(O)C(=O)NN=Cc1ccccc1	PADEL_KR3424
PADEL_KR3425	CC(O)C(=O)O	PADEL_KR3425
PADEL_KR3426	CC(O)C(O)C(O)C(C)O	PADEL_KR3426
PADEL_KR3427	CC(O)C(O)C(O)C(O)CO	PADEL_KR3427
PADEL_KR3428	CC(O)C(O)C(O)CO	PADEL_KR3428
PADEL_KR3429	CC(O)c1ccc(cc1)[N+](=O)[O-]	PADEL_KR3429
PADEL_KR3430	CC(O)c1ccccc1	PADEL_KR3430
PADEL_KR3431	CC(O)CBr	PADEL_KR3431
PADEL_KR3432	CC(O)CCC(=O)NN=C	PADEL_KR3432
PADEL_KR3433	CC(O)CCl	PADEL_KR3433
PADEL_KR3434	CC(O)CN	PADEL_KR3434
PADEL_KR3435	CC(O)CN(C)C	PADEL_KR3435
PADEL_KR3436	CC(O)CO	PADEL_KR3436
PADEL_KR3437	CC(OC=O)C(=C(Cl)Cl)Cl	PADEL_KR3437
PADEL_KR3438	CC[n+]1c(C)oc2ccccc12	PADEL_KR3438
PADEL_KR3439	CC[n+]1c2ccccc2nc3ccccc13	PADEL_KR3439
PADEL_KR3440	CC=C	PADEL_KR3440
PADEL_KR3441	CC=CC(=O)C	PADEL_KR3441
PADEL_KR3442	CC=CC(=O)N	PADEL_KR3442
PADEL_KR3443	CC=N	PADEL_KR3443
PADEL_KR3444	CC=NN	PADEL_KR3444
PADEL_KR3445	CC=NN=CC	PADEL_KR3445
PADEL_KR3446	CC=NNC(=O)C	PADEL_KR3446
PADEL_KR3447	CC=NNC(=O)CO	PADEL_KR3447
PADEL_KR3448	CC=NNC(=O)N	PADEL_KR3448
PADEL_KR3449	CC=NNC(=S)N	PADEL_KR3449
PADEL_KR3450	CC=NNC=O	PADEL_KR3450
PADEL_KR3451	CC=NNS(=O)=O	PADEL_KR3451
PADEL_KR3452	CC=NO	PADEL_KR3452
PADEL_KR3453	CC=NOC=O	PADEL_KR3453
PADEL_KR3454	CC=NOCON=CC	PADEL_KR3454
PADEL_KR3455	CC=O	PADEL_KR3455
PADEL_KR3456	CC1(C)C(CCC1(C)C(=O)O)C(=O)N	PADEL_KR3456
PADEL_KR3457	CC1(C)C(CCC1(C)C(=O)O)C=O	PADEL_KR3457
PADEL_KR3458	CC1(C)C2CCC1(C)C(=O)C2	PADEL_KR3458
PADEL_KR3459	CC1(C)CC(=CC(=O)C1)O	PADEL_KR3459
PADEL_KR3460	CC1(C)CC(=O)c2cc3ccccc3nc2C1	PADEL_KR3460
PADEL_KR3461	CC1(C)CC(=O)c2cncnc2C1	PADEL_KR3461
PADEL_KR3462	CC1(C)CC(=O)CC(=NNC=O)C1	PADEL_KR3462
PADEL_KR3463	CC1(C)CC(=O)CC(=O)C1	PADEL_KR3463
PADEL_KR3464	CC1(C)CC(=O)CC(=O)C1C=O	PADEL_KR3464
PADEL_KR3465	CC1(C)CC(O)c2cc3ccccc3nc2C1	PADEL_KR3465
PADEL_KR3466	CC1(C)CC=CC(=O)C1	PADEL_KR3466
PADEL_KR3467	CC1(C)CC1	PADEL_KR3467
PADEL_KR3468	CC1(C)CC1C=O	PADEL_KR3468
PADEL_KR3469	CC1(C)CCCC(C)(C)N1	PADEL_KR3469
PADEL_KR3470	CC1(C)CCCC1(C)C(=O)O	PADEL_KR3470
PADEL_KR3471	CC1(C)CN(C(=O)N1)c2cccc3ccccc23	PADEL_KR3471
PADEL_KR3472	CC1(C)OC(=O)CC(=O)O1	PADEL_KR3472
PADEL_KR3473	CC1(CC2CC3CC(C2)C1)C3	PADEL_KR3473
PADEL_KR3474	CC1(O)CCCCC1	PADEL_KR3474
PADEL_KR3475	Cc1[nH][nH]c(=O)c1C=N	PADEL_KR3475
PADEL_KR3476	Cc1[nH]c2ccc(C=O)cc2c1C	PADEL_KR3476
PADEL_KR3477	Cc1[nH]c2ccc(O)cc2c1C=O	PADEL_KR3477
PADEL_KR3478	Cc1[nH]c2ccccc2c1C	PADEL_KR3478
PADEL_KR3479	CC1=CC(NC(=O)N1)c2ccccc2	PADEL_KR3479
PADEL_KR3480	CC1=NN(C(=O)C1)c2c(F)c(F)c(F)c(F)c2F	PADEL_KR3480
PADEL_KR3481	CC1=NN(C(=O)C1)c2ccc(cc2)[N+](=O)[O-]	PADEL_KR3481
PADEL_KR3482	CC1C(=O)c2ccccc2C1=O	PADEL_KR3482
PADEL_KR3483	CC1C(=O)CC(C)(C)CC1=O	PADEL_KR3483
PADEL_KR3484	CC1C(C=O)C(C=O)C(C)C(C=O)C1C=O	PADEL_KR3484
PADEL_KR3485	Cc1c(C=O)oc2c(O)cccc12	PADEL_KR3485
PADEL_KR3486	Cc1c(cc(C=O)cc1[N+](=O)[O-])[N+](=O)[O-]	PADEL_KR3486
PADEL_KR3487	Cc1c(cc(cc1[N+](=O)[O-])C(=O)N)[N+](=O)[O-]	PADEL_KR3487
PADEL_KR3488	Cc1c(cccc1[N+](=O)[O-])[N+](=O)[O-]	PADEL_KR3488
PADEL_KR3489	Cc1c(O)ccc2ccccc12	PADEL_KR3489
PADEL_KR3490	Cc1c[nH]c2ccccc12	PADEL_KR3490
PADEL_KR3491	Cc1cc(=O)[nH][nH]1	PADEL_KR3491
PADEL_KR3492	Cc1cc(=O)c2ccc(O)cc2o1	PADEL_KR3492
PADEL_KR3493	Cc1cc(=O)c2ccccc2o1	PADEL_KR3493
PADEL_KR3494	Cc1cc(=O)n(c2ccccc2)n1C	PADEL_KR3494
PADEL_KR3495	Cc1cc(=O)oc2cc(O)ccc12	PADEL_KR3495
PADEL_KR3496	Cc1cc(=O)oc2ccccc12	PADEL_KR3496
PADEL_KR3497	Cc1cc(Br)cc(Br)c1O	PADEL_KR3497
PADEL_KR3498	Cc1cc(Br)cc(C(=O)O)c1O	PADEL_KR3498
PADEL_KR3499	Cc1cc(Br)cc(C)c1O	PADEL_KR3499
PADEL_KR3500	Cc1cc(C)[nH]c(=O)n1	PADEL_KR3500
PADEL_KR3501	Cc1cc(C)[nH]n1	PADEL_KR3501
PADEL_KR3502	Cc1cc(C)c(C)c(C)c1C	PADEL_KR3502
PADEL_KR3503	Cc1cc(C)c(C=NO)c(C)c1	PADEL_KR3503
PADEL_KR3504	CC1CC(C)C(C=O)C1C=O	PADEL_KR3504
PADEL_KR3505	CC1CC(C)C(C1C=O)C(=O)O	PADEL_KR3505
PADEL_KR3506	Cc1cc(C)c(O)c(n1)C(C)(C)C	PADEL_KR3506
PADEL_KR3507	Cc1cc(C)c(O)cn1	PADEL_KR3507
PADEL_KR3508	Cc1cc(C)c(S(=O)=O)c(C)c1	PADEL_KR3508
PADEL_KR3509	Cc1cc(C)cc(Br)c1	PADEL_KR3509
PADEL_KR3510	Cc1cc(C)cc(C)c1	PADEL_KR3510
PADEL_KR3511	Cc1cc(C)n2ncnc2n1	PADEL_KR3511
PADEL_KR3512	Cc1cc(C)nc(N)n1	PADEL_KR3512
PADEL_KR3513	Cc1cc(C)nc(NC=O)n1	PADEL_KR3513
PADEL_KR3514	Cc1cc(C)nc(NS(=O)=O)n1	PADEL_KR3514
PADEL_KR3515	Cc1cc(C)ncn1	PADEL_KR3515
PADEL_KR3516	Cc1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]	PADEL_KR3516
PADEL_KR3517	Cc1cc(ccc1O)[N+](=O)[O-]	PADEL_KR3517
PADEL_KR3518	Cc1cc(CO)c(C=O)c(=O)[nH]1	PADEL_KR3518
PADEL_KR3519	Cc1cc(O)c2[nH]nc[n+]2n1	PADEL_KR3519
PADEL_KR3520	Cc1cc(O)cc(O)c1	PADEL_KR3520
PADEL_KR3521	Cc1cc[nH]n1	PADEL_KR3521
PADEL_KR3522	Cc1cc2cc(ccc2[nH]1)[N+](=O)[O-]	PADEL_KR3522
PADEL_KR3523	Cc1cc2ccccc2[nH]1	PADEL_KR3523
PADEL_KR3524	Cc1cc2ccccc2n1C	PADEL_KR3524
PADEL_KR3525	Cc1ccc(Br)cc1	PADEL_KR3525
PADEL_KR3526	Cc1ccc(Br)s1	PADEL_KR3526
PADEL_KR3527	Cc1ccc(C)[nH]1	PADEL_KR3527
PADEL_KR3528	Cc1ccc(C)c(C)c1	PADEL_KR3528
PADEL_KR3529	Cc1ccc(C)cc1	PADEL_KR3529
PADEL_KR3530	Cc1ccc(C)n1c2ccccc2	PADEL_KR3530
PADEL_KR3531	Cc1ccc(C)o1	PADEL_KR3531
PADEL_KR3532	Cc1ccc(C=N)o1	PADEL_KR3532
PADEL_KR3533	Cc1ccc(C=NNC=O)o1	PADEL_KR3533
PADEL_KR3534	Cc1ccc(C=O)cc1	PADEL_KR3534
PADEL_KR3535	Cc1ccc(C=O)cc1S(=O)=O	PADEL_KR3535
PADEL_KR3536	Cc1ccc(cc1)[N+](=O)[O-]	PADEL_KR3536
PADEL_KR3537	Cc1ccc(cc1)C(=O)O	PADEL_KR3537
PADEL_KR3538	Cc1ccc(cc1)C(F)(F)F	PADEL_KR3538
PADEL_KR3539	Cc1ccc(cc1)C2(CC2C=O)c3ccc(C)cc3	PADEL_KR3539
PADEL_KR3540	Cc1ccc(cc1)c2ccccc2	PADEL_KR3540
PADEL_KR3541	Cc1ccc(cc1)S(=O)(=O)C	PADEL_KR3541
PADEL_KR3542	Cc1ccc(cc1)S(=O)(=O)N	PADEL_KR3542
PADEL_KR3543	Cc1ccc(cc1)S(=O)=O	PADEL_KR3543
PADEL_KR3544	Cc1ccc(cc1[N+](=O)[O-])S(=O)=O	PADEL_KR3544
PADEL_KR3545	Cc1ccc(CCC=O)o1	PADEL_KR3545
PADEL_KR3546	Cc1ccc(Cl)cc1	PADEL_KR3546
PADEL_KR3547	Cc1ccc(Cl)cc1Cl	PADEL_KR3547
PADEL_KR3548	Cc1ccc(F)cc1	PADEL_KR3548
PADEL_KR3549	Cc1ccc(F)cc1F	PADEL_KR3549
PADEL_KR3550	Cc1ccc(N)cc1	PADEL_KR3550
PADEL_KR3551	Cc1ccc(NC(=S)NCC(Cl)(Cl)Cl)cc1	PADEL_KR3551
PADEL_KR3552	Cc1ccc(NC(=S)SCC=O)cc1	PADEL_KR3552
PADEL_KR3553	Cc1ccc(NC=O)cc1	PADEL_KR3553
PADEL_KR3554	Cc1ccc(O)c(C)c1	PADEL_KR3554
PADEL_KR3555	Cc1ccc(O)c(C)n1	PADEL_KR3555
PADEL_KR3556	Cc1ccc(O)c(C=NNC=O)c1	PADEL_KR3556
PADEL_KR3557	Cc1ccc(O)c(c1)[N+](=O)[O-]	PADEL_KR3557
PADEL_KR3558	Cc1ccc(O)c(CCc2ccccc2)n1	PADEL_KR3558
PADEL_KR3559	Cc1ccc(O)c(O)c1	PADEL_KR3559
PADEL_KR3560	Cc1ccc(O)cc1	PADEL_KR3560
PADEL_KR3561	Cc1ccc(O)cc1C	PADEL_KR3561
PADEL_KR3562	Cc1ccc(O)cn1	PADEL_KR3562
PADEL_KR3563	Cc1ccc(o1)[N+](=O)[O-]	PADEL_KR3563
PADEL_KR3564	Cc1ccc[nH]1	PADEL_KR3564
PADEL_KR3565	Cc1ccc[nH]c1=N	PADEL_KR3565
PADEL_KR3566	Cc1ccc2[nH]c3C(=O)CCCc3c2c1	PADEL_KR3566
PADEL_KR3567	Cc1ccc2[nH]c3CCCCc3c2c1	PADEL_KR3567
PADEL_KR3568	Cc1ccc2ccccc2c1	PADEL_KR3568
PADEL_KR3569	Cc1ccc2ccccc2n1	PADEL_KR3569
PADEL_KR3570	Cc1ccc2n3CCNC4CCCc(c43)c2c1	PADEL_KR3570
PADEL_KR3571	Cc1ccc2ncsc2c1	PADEL_KR3571
PADEL_KR3572	Cc1ccc2OCOc2c1	PADEL_KR3572
PADEL_KR3573	Cc1cccc(Br)c1	PADEL_KR3573
PADEL_KR3574	Cc1cccc(C)c1	PADEL_KR3574
PADEL_KR3575	Cc1cccc(C)c1Cl	PADEL_KR3575
PADEL_KR3576	Cc1cccc(C)c1n2cnnn2	PADEL_KR3576
PADEL_KR3577	Cc1cccc(C)c1NC=O	PADEL_KR3577
PADEL_KR3578	Cc1cccc(C)n1	PADEL_KR3578
PADEL_KR3579	Cc1cccc(C=O)c1	PADEL_KR3579
PADEL_KR3580	Cc1cccc(c1)[N+](=O)[O-]	PADEL_KR3580
PADEL_KR3581	Cc1cccc(c1)C(=O)N	PADEL_KR3581
PADEL_KR3582	Cc1cccc(c1)C(=O)O	PADEL_KR3582
PADEL_KR3583	Cc1cccc(c1)C(C)(C)C	PADEL_KR3583
PADEL_KR3584	Cc1cccc(c1)c2cccc(C)c2	PADEL_KR3584
PADEL_KR3585	Cc1cccc(Cl)c1	PADEL_KR3585
PADEL_KR3586	Cc1cccc(F)c1	PADEL_KR3586
PADEL_KR3587	Cc1cccc(N)c1	PADEL_KR3587
PADEL_KR3588	Cc1cccc(N=Nc2ccccc2C)c1	PADEL_KR3588
PADEL_KR3589	Cc1cccc(NC(=S)NCC(Cl)(Cl)Cl)c1	PADEL_KR3589
PADEL_KR3590	Cc1cccc(NC=O)c1	PADEL_KR3590
PADEL_KR3591	Cc1cccc(O)c1	PADEL_KR3591
PADEL_KR3592	Cc1cccc2ccccc12	PADEL_KR3592
PADEL_KR3593	CC1CCCCC1	PADEL_KR3593
PADEL_KR3594	Cc1ccccc1[N+](=O)[O-]	PADEL_KR3594
PADEL_KR3595	Cc1ccccc1Br	PADEL_KR3595
PADEL_KR3596	Cc1ccccc1C	PADEL_KR3596
PADEL_KR3597	Cc1ccccc1C(F)(F)F	PADEL_KR3597
PADEL_KR3598	Cc1ccccc1C=O	PADEL_KR3598
PADEL_KR3599	Cc1ccccc1Cl	PADEL_KR3599
PADEL_KR3600	Cc1ccccc1F	PADEL_KR3600
PADEL_KR3601	Cc1ccccc1I	PADEL_KR3601
PADEL_KR3602	Cc1ccccc1N	PADEL_KR3602
PADEL_KR3603	Cc1ccccc1N=Nc2ccc(NC(=S)NCC(Cl)(Cl)Cl)c(C)c2	PADEL_KR3603
PADEL_KR3604	Cc1ccccc1NC(=S)NCC(Cl)(Cl)Cl	PADEL_KR3604
PADEL_KR3605	Cc1ccccc1NS(=O)=O	PADEL_KR3605
PADEL_KR3606	Cc1ccccc1O	PADEL_KR3606
PADEL_KR3607	Cc1ccccc1S(=O)(=O)O	PADEL_KR3607
PADEL_KR3608	Cc1ccccn1	PADEL_KR3608
PADEL_KR3609	Cc1cccnc1	PADEL_KR3609
PADEL_KR3610	Cc1ccco1	PADEL_KR3610
PADEL_KR3611	Cc1cccs1	PADEL_KR3611
PADEL_KR3612	Cc1ccn[nH]1	PADEL_KR3612
PADEL_KR3613	Cc1ccnc(C)c1	PADEL_KR3613
PADEL_KR3614	Cc1ccnc(N)c1	PADEL_KR3614
PADEL_KR3615	Cc1ccnc2ccc3ccccc3c12	PADEL_KR3615
PADEL_KR3616	Cc1ccncc1	PADEL_KR3616
PADEL_KR3617	Cc1ccncn1	PADEL_KR3617
PADEL_KR3618	Cc1ccoc1	PADEL_KR3618
PADEL_KR3619	Cc1ccsc1	PADEL_KR3619
PADEL_KR3620	Cc1ccsc1C	PADEL_KR3620
PADEL_KR3621	Cc1ccsc1C=N	PADEL_KR3621
PADEL_KR3622	CC1COC2(CCCCC2)O1	PADEL_KR3622
PADEL_KR3623	Cc1csc[nH+]1	PADEL_KR3623
PADEL_KR3624	Cc1csc2CCCCc12	PADEL_KR3624
PADEL_KR3625	Cc1cscn1	PADEL_KR3625
PADEL_KR3626	Cc1n[nH]cc1[N+](=O)[O-]	PADEL_KR3626
PADEL_KR3627	Cc1nc2ccccc2[nH]1	PADEL_KR3627
PADEL_KR3628	Cc1nc2ccccc2c(=O)[nH]1	PADEL_KR3628
PADEL_KR3629	Cc1nc2ccccc2c3cc4ccccc4n13	PADEL_KR3629
PADEL_KR3630	Cc1nc2ccccc2s1	PADEL_KR3630
PADEL_KR3631	Cc1ncc([nH]1)[N+](=O)[O-]	PADEL_KR3631
PADEL_KR3632	Cc1ncc[nH]1	PADEL_KR3632
PADEL_KR3633	Cc1ncc2c3CCCCc3sc2n1	PADEL_KR3633
PADEL_KR3634	Cc1nncs1	PADEL_KR3634
PADEL_KR3635	CC1OCC(O)C(O)C1O	PADEL_KR3635
PADEL_KR3636	CC1OCCO1	PADEL_KR3636
PADEL_KR3637	Cc1sc2ccccc2[n+]1CCCS(=O)(=O)O	PADEL_KR3637
PADEL_KR3638	Cc1sc2ncncc2c1C	PADEL_KR3638
PADEL_KR3639	Cc1scc(C=O)c1C	PADEL_KR3639
PADEL_KR3640	CCC	PADEL_KR3640
PADEL_KR3641	CCC#N	PADEL_KR3641
PADEL_KR3642	CCC(=NNC(=S)N)CC	PADEL_KR3642
PADEL_KR3643	CCC(=O)C	PADEL_KR3643
PADEL_KR3644	CCC(=O)C1(CC2CC3CC(C2)C1)C3	PADEL_KR3644
PADEL_KR3645	CCC(=O)c1ccccc1	PADEL_KR3645
PADEL_KR3646	CCC(=O)CC	PADEL_KR3646
PADEL_KR3647	CCC(=O)N	PADEL_KR3647
PADEL_KR3648	CCC(=O)NC	PADEL_KR3648
PADEL_KR3649	CCC(=O)NC(C)C	PADEL_KR3649
PADEL_KR3650	CCC(=O)NC(NC(=S)N)C(Cl)(Cl)Cl	PADEL_KR3650
PADEL_KR3651	CCC(=O)NN	PADEL_KR3651
PADEL_KR3652	CCC(=O)NN=C	PADEL_KR3652
PADEL_KR3653	CCC(=O)NNC=O	PADEL_KR3653
PADEL_KR3654	CCC(=O)O	PADEL_KR3654
PADEL_KR3655	CCC(=O)OC	PADEL_KR3655
PADEL_KR3656	CCC(=O)OCC=O	PADEL_KR3656
PADEL_KR3657	CCC(C)(C)C	PADEL_KR3657
PADEL_KR3658	CCC(C)(C)CC(=O)C	PADEL_KR3658
PADEL_KR3659	CCC(C)C	PADEL_KR3659
PADEL_KR3660	CCC(C)CC	PADEL_KR3660
PADEL_KR3661	CCC(C)N	PADEL_KR3661
PADEL_KR3662	CCC(C)NC=O	PADEL_KR3662
PADEL_KR3663	CCC(C=O)C(CC)C=O	PADEL_KR3663
PADEL_KR3664	CCC(CC)(C=O)C=O	PADEL_KR3664
PADEL_KR3665	CCC(CC)Cc1ccccc1	PADEL_KR3665
PADEL_KR3666	CCC(CCC(O)c1ccnc2ccccc12)C(C)C	PADEL_KR3666
PADEL_KR3667	CCC(N)C(=O)O	PADEL_KR3667
PADEL_KR3668	CCC=C(C)C	PADEL_KR3668
PADEL_KR3669	CCC=NNC=O	PADEL_KR3669
PADEL_KR3670	CCC=NO	PADEL_KR3670
PADEL_KR3671	CCC=O	PADEL_KR3671
PADEL_KR3672	CCC1(CC2CC3CC(C2)C1)C3	PADEL_KR3672
PADEL_KR3673	CCC1C(C=O)C(C=O)C(C)(CC=O)C(C=O)C1C=O	PADEL_KR3673
PADEL_KR3674	CCc1c[nH]c2ccc(O)cc12	PADEL_KR3674
PADEL_KR3675	CCc1c[nH]c2ccccc12	PADEL_KR3675
PADEL_KR3676	CCC1CC1	PADEL_KR3676
PADEL_KR3677	CCc1cc2c(=O)ccoc2cc1O	PADEL_KR3677
PADEL_KR3678	CCc1ccc(C)nc1	PADEL_KR3678
PADEL_KR3679	CCc1ccc(cc1)c2nc3ccccc3o2	PADEL_KR3679
PADEL_KR3680	CCc1ccc(O)c(O)c1	PADEL_KR3680
PADEL_KR3681	CCc1ccc(O)cc1	PADEL_KR3681
PADEL_KR3682	CCc1ccccc1	PADEL_KR3682
PADEL_KR3683	CCC1CCCCN1	PADEL_KR3683
PADEL_KR3684	CCc1cnc2ccc(Br)cc2c1	PADEL_KR3684
PADEL_KR3685	CCc1cnc2ccccc2c1	PADEL_KR3685
PADEL_KR3686	CCc1nc(C)ccc1O	PADEL_KR3686
PADEL_KR3687	CCc1nc2ccccc2[nH]1	PADEL_KR3687
PADEL_KR3688	CCc1nc2ccccc2cc1C	PADEL_KR3688
PADEL_KR3689	CCc1ncccc1O	PADEL_KR3689
PADEL_KR3690	CCc1nnc(N)s1	PADEL_KR3690
PADEL_KR3691	CCc1nncs1	PADEL_KR3691
PADEL_KR3692	CCCC	PADEL_KR3692
PADEL_KR3693	CCCC(=O)N	PADEL_KR3693
PADEL_KR3694	CCCC(=O)NC(N)C(Cl)(Cl)Cl	PADEL_KR3694
PADEL_KR3695	CCCC(=O)NC(NC(=S)N)C(Cl)(Cl)Cl	PADEL_KR3695
PADEL_KR3696	CCCC(=O)NS(=O)=O	PADEL_KR3696
PADEL_KR3697	CCCC(=O)O	PADEL_KR3697
PADEL_KR3698	CCCC(CCC)C(=O)N	PADEL_KR3698
PADEL_KR3699	CCCC(O)CO	PADEL_KR3699
PADEL_KR3700	CCCC=NNC=O	PADEL_KR3700
PADEL_KR3701	CCCC=O	PADEL_KR3701
PADEL_KR3702	CCCc1c[nH]c2ccccc12	PADEL_KR3702
PADEL_KR3703	CCCc1ccc(O)cc1	PADEL_KR3703
PADEL_KR3704	CCCc1ccccc1	PADEL_KR3704
PADEL_KR3705	CCCc1nc2ccccc2cc1CC	PADEL_KR3705
PADEL_KR3706	CCCCC	PADEL_KR3706
PADEL_KR3707	CCCCC(=O)N	PADEL_KR3707
PADEL_KR3708	CCCCC(=O)O	PADEL_KR3708
PADEL_KR3709	CCCCC=O	PADEL_KR3709
PADEL_KR3710	CCCCc1ccccc1	PADEL_KR3710
PADEL_KR3711	CCCCc1nc2ccccc2cc1CCC	PADEL_KR3711
PADEL_KR3712	CCCCCC	PADEL_KR3712
PADEL_KR3713	CCCCCC(=O)N	PADEL_KR3713
PADEL_KR3714	CCCCCC(=O)NC(NC(=S)N)C(Cl)(Cl)Cl	PADEL_KR3714
PADEL_KR3715	CCCCCC(=O)NN=C	PADEL_KR3715
PADEL_KR3716	CCCCCC(=O)O	PADEL_KR3716
PADEL_KR3717	CCCCCC(C)NC=O	PADEL_KR3717
PADEL_KR3718	CCCCCC=O	PADEL_KR3718
PADEL_KR3719	CCCCCCC	PADEL_KR3719
PADEL_KR3720	CCCCCCC(=O)NC(NC(=S)N)C(Cl)(Cl)Cl	PADEL_KR3720
PADEL_KR3721	CCCCCCC=O	PADEL_KR3721
PADEL_KR3722	CCCCCCCC	PADEL_KR3722
PADEL_KR3723	CCCCCCCC(=O)NN=C	PADEL_KR3723
PADEL_KR3724	CCCCCCCC(=O)NNC=O	PADEL_KR3724
PADEL_KR3725	CCCCCCCC=O	PADEL_KR3725
PADEL_KR3726	CCCCCCNC=O	PADEL_KR3726
PADEL_KR3727	CCCCCCO	PADEL_KR3727
PADEL_KR3728	CCCCCCOC=O	PADEL_KR3728
PADEL_KR3729	CCCCCN	PADEL_KR3729
PADEL_KR3730	CCCCCO	PADEL_KR3730
PADEL_KR3731	CCCCCOC=O	PADEL_KR3731
PADEL_KR3732	CCCCl	PADEL_KR3732
PADEL_KR3733	CCCCN	PADEL_KR3733
PADEL_KR3734	CCCCN(CCCC)CC(=O)N	PADEL_KR3734
PADEL_KR3735	CCCCNC=O	PADEL_KR3735
PADEL_KR3736	CCCCNS(=O)=O	PADEL_KR3736
PADEL_KR3737	CCCCO	PADEL_KR3737
PADEL_KR3738	CCCCOC=O	PADEL_KR3738
PADEL_KR3739	CCCCS	PADEL_KR3739
PADEL_KR3740	CCCN	PADEL_KR3740
PADEL_KR3741	CCCN(C)C	PADEL_KR3741
PADEL_KR3742	CCCNC=O	PADEL_KR3742
PADEL_KR3743	CCCNS(=O)=O	PADEL_KR3743
PADEL_KR3744	CCCO	PADEL_KR3744
PADEL_KR3745	CCCOC(=O)CO	PADEL_KR3745
PADEL_KR3746	CCCOC=O	PADEL_KR3746
PADEL_KR3747	CCCS(=O)(=O)O	PADEL_KR3747
PADEL_KR3748	CCCS(=O)(=O)O[Na]	PADEL_KR3748
PADEL_KR3749	CCl	PADEL_KR3749
PADEL_KR3750	CCN	PADEL_KR3750
PADEL_KR3751	CCN(C)C	PADEL_KR3751
PADEL_KR3752	CCN(C)CC	PADEL_KR3752
PADEL_KR3753	CCN(C)CC(=O)N	PADEL_KR3753
PADEL_KR3754	CCN(CC(O)CO)S(=O)(=O)O	PADEL_KR3754
PADEL_KR3755	CCN(CC)C(=S)N	PADEL_KR3755
PADEL_KR3756	CCN(CC)C=O	PADEL_KR3756
PADEL_KR3757	CCN(CC)CC	PADEL_KR3757
PADEL_KR3758	CCN(CC)CC(=O)N	PADEL_KR3758
PADEL_KR3759	CCN(CC)CC(C)O	PADEL_KR3759
PADEL_KR3760	CCN(CC)CC=O	PADEL_KR3760
PADEL_KR3761	CCN(CC)CCC=O	PADEL_KR3761
PADEL_KR3762	CCN(CC)CCCC(C)N	PADEL_KR3762
PADEL_KR3763	CCN(CC)CCN	PADEL_KR3763
PADEL_KR3764	CCN(CC)CCNC=O	PADEL_KR3764
PADEL_KR3765	CCN(CC)CCOC=O	PADEL_KR3765
PADEL_KR3766	CCN(CC)S(=O)=O	PADEL_KR3766
PADEL_KR3767	CCN(CCO)C=O	PADEL_KR3767
PADEL_KR3768	CCN=C	PADEL_KR3768
PADEL_KR3769	CCN1C(=O)c2cccc3cccc1c23	PADEL_KR3769
PADEL_KR3770	CCN1C(=O)c2ccccc2C1=O	PADEL_KR3770
PADEL_KR3771	CCn1c2ccccc2c3cc(C=NNC=O)ccc13	PADEL_KR3771
PADEL_KR3772	CCN1CCOCC1	PADEL_KR3772
PADEL_KR3773	CCNC	PADEL_KR3773
PADEL_KR3774	CCNC(=NCC)S	PADEL_KR3774
PADEL_KR3775	CCNC(=O)C	PADEL_KR3775
PADEL_KR3776	CCNC(=O)C=C	PADEL_KR3776
PADEL_KR3777	CCNC(=O)CC	PADEL_KR3777
PADEL_KR3778	CCNC(=O)CO	PADEL_KR3778
PADEL_KR3779	CCNC(=O)N	PADEL_KR3779
PADEL_KR3780	CCNC(=S)NC(CC=O)c1ccccc1	PADEL_KR3780
PADEL_KR3781	CCNC=O	PADEL_KR3781
PADEL_KR3782	CCNCC	PADEL_KR3782
PADEL_KR3783	CCNCC(=O)N	PADEL_KR3783
PADEL_KR3784	CCNCC(O)CO	PADEL_KR3784
PADEL_KR3785	CCNCC=O	PADEL_KR3785
PADEL_KR3786	CCNCCO	PADEL_KR3786
PADEL_KR3787	CCNS(=O)=O	PADEL_KR3787
PADEL_KR3788	CCO	PADEL_KR3788
PADEL_KR3789	CCOC	PADEL_KR3789
PADEL_KR3790	CCOC(=O)C	PADEL_KR3790
PADEL_KR3791	CCOC(=O)C(=C)C#N	PADEL_KR3791
PADEL_KR3792	CCOC(=O)C(C)NC(=O)C	PADEL_KR3792
PADEL_KR3793	CCOC(=O)C(C)NC=O	PADEL_KR3793
PADEL_KR3794	CCOC(=O)C=CC	PADEL_KR3794
PADEL_KR3795	CCOC(=O)CC	PADEL_KR3795
PADEL_KR3796	CCOC(=O)CC(=O)N	PADEL_KR3796
PADEL_KR3797	CCOC(=O)CC(=O)OCC	PADEL_KR3797
PADEL_KR3798	CCOC(=O)CC=O	PADEL_KR3798
PADEL_KR3799	CCOC(=O)CCC(=O)N	PADEL_KR3799
PADEL_KR3800	CCOC(=O)CN	PADEL_KR3800
PADEL_KR3801	CCOC(=O)CNC=O	PADEL_KR3801
PADEL_KR3802	CCOC(=O)CS	PADEL_KR3802
PADEL_KR3803	CCOC(=O)N	PADEL_KR3803
PADEL_KR3804	CCOC(=O)NC(N)C(Cl)(Cl)Cl	PADEL_KR3804
PADEL_KR3805	CCOC(=O)NN=C	PADEL_KR3805
PADEL_KR3806	CCOC=O	PADEL_KR3806
PADEL_KR3807	CCOP(=O)(CN)OCC	PADEL_KR3807
PADEL_KR3808	CCOP(=O)(N)OCC	PADEL_KR3808
PADEL_KR3809	CCS	PADEL_KR3809
PADEL_KR3810	CCS(=O)(=O)C(=C(N)N)S(=O)(=O)CC	PADEL_KR3810
PADEL_KR3811	CCS(=O)(=O)CCC(=O)N	PADEL_KR3811
PADEL_KR3812	CCS(=O)(=O)CCC=O	PADEL_KR3812
PADEL_KR3813	CCS(=O)(=O)O	PADEL_KR3813
PADEL_KR3814	CCS(=O)=O	PADEL_KR3814
PADEL_KR3815	CCS=O	PADEL_KR3815
PADEL_KR3816	CCSC	PADEL_KR3816
PADEL_KR3817	CCSC(=N)N	PADEL_KR3817
PADEL_KR3818	CCSC(C)C	PADEL_KR3818
PADEL_KR3819	CCSC=S	PADEL_KR3819
PADEL_KR3820	CCSCC	PADEL_KR3820
PADEL_KR3821	Cl	PADEL_KR3821
PADEL_KR3822	ClC(=C(Cl)COC=O)Cl	PADEL_KR3822
PADEL_KR3823	ClC(=C)Cl	PADEL_KR3823
PADEL_KR3824	ClC(Cl)(Cl)C=O	PADEL_KR3824
PADEL_KR3825	ClC(Cl)(Cl)CNC(=S)Nc1ccc(cc1)S(=O)=O	PADEL_KR3825
PADEL_KR3826	ClC(Cl)(Cl)CNC(=S)Nc1ccc(N=Nc2ccccc2)cc1	PADEL_KR3826
PADEL_KR3827	ClC(Cl)(Cl)CNC(=S)Nc1cccc2ccccc12	PADEL_KR3827
PADEL_KR3828	ClC(Cl)(Cl)CNC(=S)Nc1cccc2cccnc12	PADEL_KR3828
PADEL_KR3829	ClC(Cl)(Cl)CNC(=S)Nc1ccccc1	PADEL_KR3829
PADEL_KR3830	ClC(Cl)(Cl)CNC(=S)Nc1ccccc1C=O	PADEL_KR3830
PADEL_KR3831	ClC(Cl)(Cl)CNC(=S)Nc1sc2CCCCc2c1C=O	PADEL_KR3831
PADEL_KR3832	ClC(Cl)(Cl)CNC=O	PADEL_KR3832
PADEL_KR3833	ClC(Cl)(Cl)CNS(=O)=O	PADEL_KR3833
PADEL_KR3834	ClC(Cl)Cl	PADEL_KR3834
PADEL_KR3835	Clc1c(C=O)sc2ccccc12	PADEL_KR3835
PADEL_KR3836	Clc1cc(Cl)cc(C=O)c1	PADEL_KR3836
PADEL_KR3837	Clc1cc(Cl)cc(Cl)c1	PADEL_KR3837
PADEL_KR3838	Clc1ccc(C=C2SC(=S)NC2=O)cc1	PADEL_KR3838
PADEL_KR3839	Clc1ccc(C=N)c(Cl)c1	PADEL_KR3839
PADEL_KR3840	Clc1ccc(C=N)cc1	PADEL_KR3840
PADEL_KR3841	Clc1ccc(C=NNC=O)c(Cl)c1	PADEL_KR3841
PADEL_KR3842	Clc1ccc(C=NNC=O)cc1	PADEL_KR3842
PADEL_KR3843	Clc1ccc(C=O)c(Cl)c1	PADEL_KR3843
PADEL_KR3844	Clc1ccc(C=O)cc1	PADEL_KR3844
PADEL_KR3845	Clc1ccc(C=O)cc1Cl	PADEL_KR3845
PADEL_KR3846	Clc1ccc(cc1)N2C(=O)CCC2=O	PADEL_KR3846
PADEL_KR3847	Clc1ccc(cc1)N2CCNCC2	PADEL_KR3847
PADEL_KR3848	Clc1ccc(cc1)S(=O)(=O)c2cccc(c2)S(=O)=O	PADEL_KR3848
PADEL_KR3849	Clc1ccc(cc1)S(=O)=O	PADEL_KR3849
PADEL_KR3850	Clc1ccc(cc1Cl)S(=O)(=O)c2cccc(c2)S(=O)=O	PADEL_KR3850
PADEL_KR3851	Clc1ccc(cc1Cl)S(=O)=O	PADEL_KR3851
PADEL_KR3852	Clc1ccc(Cl)c(Cl)c1	PADEL_KR3852
PADEL_KR3853	Clc1ccc(Cl)c(NC(=S)NCC(Cl)(Cl)Cl)c1	PADEL_KR3853
PADEL_KR3854	Clc1ccc(Cl)c(NC=O)c1	PADEL_KR3854
PADEL_KR3855	Clc1ccc(Cl)cc1	PADEL_KR3855
PADEL_KR3856	Clc1ccc(NC=O)c(Cl)c1	PADEL_KR3856
PADEL_KR3857	Clc1ccc(NC=O)cc1	PADEL_KR3857
PADEL_KR3858	Clc1ccc(NC=O)cc1Cl	PADEL_KR3858
PADEL_KR3859	Clc1ccc(NS(=O)=O)cc1	PADEL_KR3859
PADEL_KR3860	Clc1ccc2[nH]c3ccc(Cl)cc3c2c1	PADEL_KR3860
PADEL_KR3861	Clc1ccc2ocnc2c1	PADEL_KR3861
PADEL_KR3862	Clc1cccc(Br)c1	PADEL_KR3862
PADEL_KR3863	Clc1cccc(C=N)c1	PADEL_KR3863
PADEL_KR3864	Clc1cccc(C=O)c1	PADEL_KR3864
PADEL_KR3865	Clc1cccc(c1)N2C(=O)CCC2=O	PADEL_KR3865
PADEL_KR3866	Clc1cccc(Cl)c1	PADEL_KR3866
PADEL_KR3867	Clc1cccc(NC=O)c1	PADEL_KR3867
PADEL_KR3868	Clc1cccc2ccccc12	PADEL_KR3868
PADEL_KR3869	Clc1ccccc1	PADEL_KR3869
PADEL_KR3870	Clc1ccccc1Br	PADEL_KR3870
PADEL_KR3871	Clc1ccccc1C=NNC=O	PADEL_KR3871
PADEL_KR3872	Clc1ccccc1C=O	PADEL_KR3872
PADEL_KR3873	Clc1ccccc1Cl	PADEL_KR3873
PADEL_KR3874	Clc1ccccc1NC=O	PADEL_KR3874
PADEL_KR3875	Clc1ccccc1S(=O)=O	PADEL_KR3875
PADEL_KR3876	Clc1cccnc1	PADEL_KR3876
PADEL_KR3877	Clc1csc2ccccc12	PADEL_KR3877
PADEL_KR3878	Clc1ncnc(Cl)n1	PADEL_KR3878
PADEL_KR3879	Clc1ncncn1	PADEL_KR3879
PADEL_KR3880	ClCC=O	PADEL_KR3880
PADEL_KR3881	ClCCl	PADEL_KR3881
PADEL_KR3882	CN	PADEL_KR3882
PADEL_KR3883	CN(C(=O)CCC(=O)O)C(C)(C)C	PADEL_KR3883
PADEL_KR3884	CN(C)C	PADEL_KR3884
PADEL_KR3885	CN(C)C(=N)C	PADEL_KR3885
PADEL_KR3886	CN(C)C(=N)NC(=N)N	PADEL_KR3886
PADEL_KR3887	CN(C)C(=O)N	PADEL_KR3887
PADEL_KR3888	CN(C)C=N	PADEL_KR3888
PADEL_KR3889	CN(C)C=O	PADEL_KR3889
PADEL_KR3890	CN(C)c1ccc(C=NNC=O)cc1	PADEL_KR3890
PADEL_KR3891	CN(C)c1ccc2ccccc2n1	PADEL_KR3891
PADEL_KR3892	CN(C)c1ccccc1	PADEL_KR3892
PADEL_KR3893	CN(C)CC(=O)N	PADEL_KR3893
PADEL_KR3894	CN(C)CC=O	PADEL_KR3894
PADEL_KR3895	CN(C)CCC=O	PADEL_KR3895
PADEL_KR3896	CN(C)CCCNC(=O)C(=C)NC=O	PADEL_KR3896
PADEL_KR3897	CN(C)CCCNC=O	PADEL_KR3897
PADEL_KR3898	CN(C)CCCOC=O	PADEL_KR3898
PADEL_KR3899	CN(C)CCOC=O	PADEL_KR3899
PADEL_KR3900	CN(C)N1C(=O)CCC1=O	PADEL_KR3900
PADEL_KR3901	CN(C)S(=O)=O	PADEL_KR3901
PADEL_KR3902	CN(C=O)C(C)(C)C	PADEL_KR3902
PADEL_KR3903	CN(C=O)c1ccc(I)cc1	PADEL_KR3903
PADEL_KR3904	CN(CC(O)CO)S(=O)(=O)O	PADEL_KR3904
PADEL_KR3905	CN(CCO)CCO	PADEL_KR3905
PADEL_KR3906	CN(S(=O)=O)C(C)(C)C	PADEL_KR3906
PADEL_KR3907	CN=C	PADEL_KR3907
PADEL_KR3908	CN=c1cc[nH]cc1	PADEL_KR3908
PADEL_KR3909	CN1C(=O)C(=NNC(=O)CO)c2cc(Br)ccc12	PADEL_KR3909
PADEL_KR3910	CN1C(=O)c2ccccc2C1=O	PADEL_KR3910
PADEL_KR3911	CN1C2CCC1CCC2	PADEL_KR3911
PADEL_KR3912	Cn1cc(Br)c(n1)C(=O)N	PADEL_KR3912
PADEL_KR3913	CN1CCc2cc3ccccc3nc12	PADEL_KR3913
PADEL_KR3914	CN1CCCC1	PADEL_KR3914
PADEL_KR3915	CN1CCCCC1	PADEL_KR3915
PADEL_KR3916	Cn1cccn1	PADEL_KR3916
PADEL_KR3917	CN1CCN(CC1)c2ccc(Cl)cc2	PADEL_KR3917
PADEL_KR3918	CN1CCN(CC1)c2ccc(F)cc2	PADEL_KR3918
PADEL_KR3919	CN1CCN(CC1)c2ccccc2	PADEL_KR3919
PADEL_KR3920	CN1CCN(CC1)c2ccccn2	PADEL_KR3920
PADEL_KR3921	CN1CCNCC1	PADEL_KR3921
PADEL_KR3922	CN1CCOCC1	PADEL_KR3922
PADEL_KR3923	Cn1cnc(c1)[N+](=O)[O-]	PADEL_KR3923
PADEL_KR3924	Cn1ncc([N+](=O)[O-])c1C(=O)N	PADEL_KR3924
PADEL_KR3925	Cn1nnc2ccccc12	PADEL_KR3925
PADEL_KR3926	CNC	PADEL_KR3926
PADEL_KR3927	CNC(=N)NC(=N)N	PADEL_KR3927
PADEL_KR3928	CNC(=O)C	PADEL_KR3928
PADEL_KR3929	CNC(=O)C(=C)NC=O	PADEL_KR3929
PADEL_KR3930	CNC(=O)CCC(=O)O	PADEL_KR3930
PADEL_KR3931	CNC(=O)CCl	PADEL_KR3931
PADEL_KR3932	CNC(=O)CO	PADEL_KR3932
PADEL_KR3933	CNC(=O)N	PADEL_KR3933
PADEL_KR3934	CNC(=O)O	PADEL_KR3934
PADEL_KR3935	CNC(=S)NC	PADEL_KR3935
PADEL_KR3936	CNC(C)(C)C	PADEL_KR3936
PADEL_KR3937	CNC(C)C	PADEL_KR3937
PADEL_KR3938	CNC(C)C(=O)O	PADEL_KR3938
PADEL_KR3939	CNC(NC=O)C(Cl)(Cl)Cl	PADEL_KR3939
PADEL_KR3940	CNC=C	PADEL_KR3940
PADEL_KR3941	CNC=C1C(=O)NC(=O)NC1=O	PADEL_KR3941
PADEL_KR3942	CNC=O	PADEL_KR3942
PADEL_KR3943	CNc1ccccc1	PADEL_KR3943
PADEL_KR3944	CNc1ncncn1	PADEL_KR3944
PADEL_KR3945	CNCC(=O)N	PADEL_KR3945
PADEL_KR3946	CNCC(C)O	PADEL_KR3946
PADEL_KR3947	CNCC(O)CO	PADEL_KR3947
PADEL_KR3948	CNCCO	PADEL_KR3948
PADEL_KR3949	CNN	PADEL_KR3949
PADEL_KR3950	CNN=C	PADEL_KR3950
PADEL_KR3951	CNN=C1c2n[nH]nc2C(=NNC)c3n[nH]nc13	PADEL_KR3951
PADEL_KR3952	CNn1cnnc1	PADEL_KR3952
PADEL_KR3953	CNNC(=O)C	PADEL_KR3953
PADEL_KR3954	CNS(=O)(=O)NC(=O)N	PADEL_KR3954
PADEL_KR3955	CNS(=O)=O	PADEL_KR3955
PADEL_KR3956	CO	PADEL_KR3956
PADEL_KR3957	COC	PADEL_KR3957
PADEL_KR3958	COC(=N)c1ccc(C)cc1	PADEL_KR3958
PADEL_KR3959	COC(=O)C	PADEL_KR3959
PADEL_KR3960	COC(=O)C(C)NC(=O)CO	PADEL_KR3960
PADEL_KR3961	COC(=O)C(C)NC=O	PADEL_KR3961
PADEL_KR3962	COC(=O)C(O)C(F)(F)F	PADEL_KR3962
PADEL_KR3963	COC(=O)CCC(=O)N	PADEL_KR3963
PADEL_KR3964	COC(=O)CCC(=O)O	PADEL_KR3964
PADEL_KR3965	COC(=O)CCS(=O)=O	PADEL_KR3965
PADEL_KR3966	COC(=O)CN	PADEL_KR3966
PADEL_KR3967	COC(=O)CO	PADEL_KR3967
PADEL_KR3968	COC(=O)N	PADEL_KR3968
PADEL_KR3969	COC(=O)O	PADEL_KR3969
PADEL_KR3970	COC=NC(NC(=S)N)C(Cl)(Cl)Cl	PADEL_KR3970
PADEL_KR3971	COC=O	PADEL_KR3971
PADEL_KR3972	COc1c(Cl)cc(Cl)cc1C=NNC=O	PADEL_KR3972
PADEL_KR3973	COc1cc(C=NNC=O)ccc1O	PADEL_KR3973
PADEL_KR3974	COc1cc(cc(OC)c1OC)C(=O)N	PADEL_KR3974
PADEL_KR3975	COc1cc(N)nc(OC)n1	PADEL_KR3975
PADEL_KR3976	COc1ccc(C(=NNC=O)C)c(OC)c1	PADEL_KR3976
PADEL_KR3977	COc1ccc(C=C2SC(=S)NC2=O)cc1	PADEL_KR3977
PADEL_KR3978	COc1ccc(C=CC(=O)NC(=S)N)cc1OC	PADEL_KR3978
PADEL_KR3979	COc1ccc(C=NNC(=O)CO)cc1[N+](=O)[O-]	PADEL_KR3979
PADEL_KR3980	COc1ccc(C=NNC=O)c(OC)c1	PADEL_KR3980
PADEL_KR3981	COc1ccc(C=NNC=O)cc1	PADEL_KR3981
PADEL_KR3982	COc1ccc(C=NNC=O)cc1OC	PADEL_KR3982
PADEL_KR3983	COc1ccc(cc1)[N+](=O)[O-]	PADEL_KR3983
PADEL_KR3984	COc1ccc(cc1)C(=NNC=O)C	PADEL_KR3984
PADEL_KR3985	COc1ccc(cc1)C(=O)N	PADEL_KR3985
PADEL_KR3986	COc1ccc(cc1)N2C(=O)CCC2=O	PADEL_KR3986
PADEL_KR3987	COc1ccc(Cl)cc1Cl	PADEL_KR3987
PADEL_KR3988	COc1ccc(N)nn1	PADEL_KR3988
PADEL_KR3989	COc1ccc(OC)cc1	PADEL_KR3989
PADEL_KR3990	COc1ccc2[nH]ccc2c1	PADEL_KR3990
PADEL_KR3991	COc1ccc2ccccc2c1	PADEL_KR3991
PADEL_KR3992	COc1ccc2ccccc2c1C=NNC(=O)CO	PADEL_KR3992
PADEL_KR3993	COc1ccc2sc(C)[nH+]c2c1	PADEL_KR3993
PADEL_KR3994	COc1cccc(Br)c1	PADEL_KR3994
PADEL_KR3995	COc1cccc(C=NNC(=O)CO)c1	PADEL_KR3995
PADEL_KR3996	COc1cccc(c1)[N+](=O)[O-]	PADEL_KR3996
PADEL_KR3997	COc1cccc(c1)C(=O)O	PADEL_KR3997
PADEL_KR3998	COc1cccc(OC)c1	PADEL_KR3998
PADEL_KR3999	COc1cccc(OC)c1OC	PADEL_KR3999
PADEL_KR4000	COc1ccccc1	PADEL_KR4000
PADEL_KR4001	COc1ccccc1C=NNC(=O)CO	PADEL_KR4001
PADEL_KR4002	COc1ccccc1C=NNC=O	PADEL_KR4002
PADEL_KR4003	COc1ccccc1Cl	PADEL_KR4003
PADEL_KR4004	COc1ccccc1N2CCNCC2	PADEL_KR4004
PADEL_KR4005	COc1ccccc1O	PADEL_KR4005
PADEL_KR4006	COc1ccccc1OC	PADEL_KR4006
PADEL_KR4007	COc1cccnn1	PADEL_KR4007
PADEL_KR4008	COc1ccnc(OC)n1	PADEL_KR4008
PADEL_KR4009	COc1cnccn1	PADEL_KR4009
PADEL_KR4010	COc1nc(C)nc(NC=O)n1	PADEL_KR4010
PADEL_KR4011	COc1nccnc1N	PADEL_KR4011
PADEL_KR4012	COc1ncnc(C)n1	PADEL_KR4012
PADEL_KR4013	COc1ncnc(OC)n1	PADEL_KR4013
PADEL_KR4014	COc1ncncn1	PADEL_KR4014
PADEL_KR4015	COCC(C)O	PADEL_KR4015
PADEL_KR4016	COCC(O)CNC(C)C	PADEL_KR4016
PADEL_KR4017	COP(=O)(CN)OC	PADEL_KR4017
PADEL_KR4018	COS(=O)=O	PADEL_KR4018
PADEL_KR4019	CS	PADEL_KR4019
PADEL_KR4020	CS(=O)(=O)c1ccccc1	PADEL_KR4020
PADEL_KR4021	CS(=O)(=O)N	PADEL_KR4021
PADEL_KR4022	CS(=O)(=O)O	PADEL_KR4022
PADEL_KR4023	CS(=O)=O	PADEL_KR4023
PADEL_KR4024	CSC(=N)N	PADEL_KR4024
PADEL_KR4025	CSC(=S)NN=C	PADEL_KR4025
PADEL_KR4026	CS(c1ccc(C)cc1)	PADEL_KR4026
PADEL_KR4027	CS(c1ccc(O)cc1)	PADEL_KR4027
PADEL_KR4028	CS(c1ccccc1)	PADEL_KR4028
PADEL_KR4029	CS(c1nc2ccccc2[nH]1)	PADEL_KR4029
PADEL_KR4030	CSCC(=O)NN=C	PADEL_KR4030
PADEL_KR4031	CSCCCC(=O)O	PADEL_KR4031
PADEL_KR4032	F	PADEL_KR4032
PADEL_KR4033	FC(F)(C=O)C1(F)OC(F)(F)C(F)(F)C1(F)F	PADEL_KR4033
PADEL_KR4034	FC(F)(F)C(F)(F)C(F)(F)OC(F)(C=O)C(F)(F)F	PADEL_KR4034
PADEL_KR4035	FC(F)(F)C(F)(F)C(F)(F)S	PADEL_KR4035
PADEL_KR4036	FC(F)(F)C(F)(F)C=O	PADEL_KR4036
PADEL_KR4037	FC(F)(F)C(Oc1ncnc(OC(C(F)(F)F)C(F)(F)F)n1)C(F)(F)F	PADEL_KR4037
PADEL_KR4038	FC(F)(F)C(Oc1ncncn1)C(F)(F)F	PADEL_KR4038
PADEL_KR4039	FC(F)(F)C=O	PADEL_KR4039
PADEL_KR4040	FC(F)(F)c1ccc(Cl)c(NC(=S)NCC(Cl)(Cl)Cl)c1	PADEL_KR4040
PADEL_KR4041	FC(F)(F)c1ccc(Cl)cc1	PADEL_KR4041
PADEL_KR4042	FC(F)(F)c1ccc(S(c2ccccc2))cc1	PADEL_KR4042
PADEL_KR4043	FC(F)(F)c1ccc2S(c3ccccc3Nc2c1)	PADEL_KR4043
PADEL_KR4044	FC(F)(F)c1cccc(c1)S(=O)=O	PADEL_KR4044
PADEL_KR4045	FC(F)(F)c1cccc(NC=O)c1	PADEL_KR4045
PADEL_KR4046	FC(F)(F)c1ccccc1	PADEL_KR4046
PADEL_KR4047	FC(F)(F)CCS	PADEL_KR4047
PADEL_KR4048	FC(F)(F)COc1ncncn1	PADEL_KR4048
PADEL_KR4049	FC(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C=O	PADEL_KR4049
PADEL_KR4050	FC(F)(F)S	PADEL_KR4050
PADEL_KR4051	FC(F)(F)S(=O)=O	PADEL_KR4051
PADEL_KR4052	FC(F)C(F)F	PADEL_KR4052
PADEL_KR4053	FC(F)F	PADEL_KR4053
PADEL_KR4054	Fc1cc(F)c(F)c(F)c1F	PADEL_KR4054
PADEL_KR4055	Fc1cc(F)c(F)cc1F	PADEL_KR4055
PADEL_KR4056	Fc1ccc(C=C2SC(=S)NC2=O)cc1	PADEL_KR4056
PADEL_KR4057	Fc1ccc(C=NNC=O)cc1	PADEL_KR4057
PADEL_KR4058	Fc1ccc(C=O)c(C=O)c1	PADEL_KR4058
PADEL_KR4059	Fc1ccc(C=O)cc1	PADEL_KR4059
PADEL_KR4060	Fc1ccc(C=O)cc1F	PADEL_KR4060
PADEL_KR4061	Fc1ccc(cc1)N2CCNCC2	PADEL_KR4061
PADEL_KR4062	Fc1ccc(NC=O)cc1	PADEL_KR4062
PADEL_KR4063	Fc1ccc2c(Cl)csc2c1	PADEL_KR4063
PADEL_KR4064	Fc1cccc(C=O)c1	PADEL_KR4064
PADEL_KR4065	Fc1cccc(F)c1	PADEL_KR4065
PADEL_KR4066	Fc1cccc(F)c1C=O	PADEL_KR4066
PADEL_KR4067	Fc1ccccc1	PADEL_KR4067
PADEL_KR4068	Fc1ccccc1C=N	PADEL_KR4068
PADEL_KR4069	Fc1ccccc1C=NNC=O	PADEL_KR4069
PADEL_KR4070	Fc1ccccc1C=O	PADEL_KR4070
PADEL_KR4071	Fc1ccccc1Cl	PADEL_KR4071
PADEL_KR4072	FC1OC(F)(F)C(F)(F)C1(F)F	PADEL_KR4072
PADEL_KR4073	FCC=O	PADEL_KR4073
PADEL_KR4074	I	PADEL_KR4074
PADEL_KR4075	Ic1ccc(NC=O)cc1	PADEL_KR4075
PADEL_KR4076	Ic1cccc(C=O)c1	PADEL_KR4076
PADEL_KR4077	Ic1ccccc1	PADEL_KR4077
PADEL_KR4078	Ic1ccccc1C=O	PADEL_KR4078
PADEL_KR4079	Ic1cn[nH]c1	PADEL_KR4079
PADEL_KR4080	N	PADEL_KR4080
PADEL_KR4081	N#Cc1ccccc1	PADEL_KR4081
PADEL_KR4082	N#CCC#N	PADEL_KR4082
PADEL_KR4083	N(=Nc1ccccc1)c2ccccc2	PADEL_KR4083
PADEL_KR4084	N(=Nc1ccccc1)c2nc3ccccc3s2	PADEL_KR4084
PADEL_KR4085	N(N=Cc1ccco1)c2ncncn2	PADEL_KR4085
PADEL_KR4086	N=[N+]=[N-]	PADEL_KR4086
PADEL_KR4087	N=C(C=O)c1ccccc1	PADEL_KR4087
PADEL_KR4088	N=C(c1ccccc1)c2ccccc2	PADEL_KR4088
PADEL_KR4089	N=C(Nc1ccccc1)SCC=O	PADEL_KR4089
PADEL_KR4090	N=c1[nH]c(cs1)c2ccccc2	PADEL_KR4090
PADEL_KR4091	N=c1[nH]c2ccccc2[nH]1	PADEL_KR4091
PADEL_KR4092	N=c1[nH]c2CCCCc2s1	PADEL_KR4092
PADEL_KR4093	N=c1[nH]ccs1	PADEL_KR4093
PADEL_KR4094	N=C1C(=O)Nc2ccccc12	PADEL_KR4094
PADEL_KR4095	N=c1c2CCCc2[nH]c3ccccc13	PADEL_KR4095
PADEL_KR4096	N=C1CC(=O)c2ccccc12	PADEL_KR4096
PADEL_KR4097	N=C1CC(=O)NC(=O)N1	PADEL_KR4097
PADEL_KR4098	N=c1cc[nH]c2ccccc12	PADEL_KR4098
PADEL_KR4099	N=c1cc[nH]cc1	PADEL_KR4099
PADEL_KR4100	N=c1cccc[nH]1	PADEL_KR4100
PADEL_KR4101	N=C1CCCc2ccccc2N1	PADEL_KR4101
PADEL_KR4102	N=C1NC(=O)CS1	PADEL_KR4102
PADEL_KR4103	N=c1nccc[nH]1	PADEL_KR4103
PADEL_KR4104	N=c1ncccn1CC=O	PADEL_KR4104
PADEL_KR4105	N=Cc1c[nH]c2ccccc12	PADEL_KR4105
PADEL_KR4106	N=Cc1c2ccccc2cc3ccccc13	PADEL_KR4106
PADEL_KR4107	N=Cc1ccc(C#Cc2ccccc2)cc1	PADEL_KR4107
PADEL_KR4108	N=Cc1ccc(C=N)cc1	PADEL_KR4108
PADEL_KR4109	N=Cc1ccc[nH]1	PADEL_KR4109
PADEL_KR4110	N=Cc1ccc2[nH]c3ccccc3c2c1	PADEL_KR4110
PADEL_KR4111	N=Cc1ccc2OCOc2c1	PADEL_KR4111
PADEL_KR4112	N=Cc1cccc2ccccc12	PADEL_KR4112
PADEL_KR4113	N=Cc1ccccc1	PADEL_KR4113
PADEL_KR4114	N=Cc1cccnc1	PADEL_KR4114
PADEL_KR4115	N=Cc1ccco1	PADEL_KR4115
PADEL_KR4116	N=N	PADEL_KR4116
PADEL_KR4117	N=O	PADEL_KR4117
PADEL_KR4118	N1C(Nc2ccccc12)c3ccccc3	PADEL_KR4118
PADEL_KR4119	N1C=CC2C=CC=CC12	PADEL_KR4119
PADEL_KR4120	N1c2ccccc2C=Cc3ccccc13	PADEL_KR4120
PADEL_KR4121	N1c2ccccc2S(c3ccccc13)	PADEL_KR4121
PADEL_KR4122	NC(=N)N	PADEL_KR4122
PADEL_KR4123	NC(=N)NC(=N)N	PADEL_KR4123
PADEL_KR4124	NC(=N)NC(=O)N	PADEL_KR4124
PADEL_KR4125	NC(=N)NCCCC(NC=O)C(=O)N	PADEL_KR4125
PADEL_KR4126	NC(=N)NN=C	PADEL_KR4126
PADEL_KR4127	NC(=N)S	PADEL_KR4127
PADEL_KR4128	NC(=N)SCC=O	PADEL_KR4128
PADEL_KR4129	NC(=Nc1ccccc1)S	PADEL_KR4129
PADEL_KR4130	NC(=O)C(=C)C#N	PADEL_KR4130
PADEL_KR4131	NC(=O)C(=O)NN=C1C(=O)Nc2ccccc12	PADEL_KR4131
PADEL_KR4132	NC(=O)C(C(C(=O)O)C(=O)O)C(=O)O	PADEL_KR4132
PADEL_KR4133	NC(=O)C(C=O)S(=O)=O	PADEL_KR4133
PADEL_KR4134	NC(=O)C(Cl)(Cl)Cl	PADEL_KR4134
PADEL_KR4135	NC(=O)C(F)(F)C(F)(F)F	PADEL_KR4135
PADEL_KR4136	NC(=O)C(F)(F)F	PADEL_KR4136
PADEL_KR4137	NC(=O)C(F)(F)OC(F)(F)C(F)(F)OC(F)(F)F	PADEL_KR4137
PADEL_KR4138	NC(=O)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F	PADEL_KR4138
PADEL_KR4139	NC(=O)C=C	PADEL_KR4139
PADEL_KR4140	NC(=O)C=CC(=O)O	PADEL_KR4140
PADEL_KR4141	NC(=O)C=Cc1cccc(c1)[N+](=O)[O-]	PADEL_KR4141
PADEL_KR4142	NC(=O)C=Cc1ccccc1	PADEL_KR4142
PADEL_KR4143	NC(=O)C1(CC2CC3CC(C2)C1)C3	PADEL_KR4143
PADEL_KR4144	NC(=O)C1C(C2CC1C=C2)C(=O)O	PADEL_KR4144
PADEL_KR4145	NC(=O)c1c(cccc1[N+](=O)[O-])C(=O)O	PADEL_KR4145
PADEL_KR4146	NC(=O)C1C2CCCCC12	PADEL_KR4146
PADEL_KR4147	NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]	PADEL_KR4147
PADEL_KR4148	NC(=O)c1cc(ccc1Cl)[N+](=O)[O-]	PADEL_KR4148
PADEL_KR4149	NC(=O)C1CC1(c2ccccc2)c3ccccc3	PADEL_KR4149
PADEL_KR4150	NC(=O)C1CC1c2ccccc2	PADEL_KR4150
PADEL_KR4151	NC(=O)C1CC21CCC2	PADEL_KR4151
PADEL_KR4152	NC(=O)c1cc2ccccc2oc1=O	PADEL_KR4152
PADEL_KR4153	NC(=O)c1ccc(Br)cc1	PADEL_KR4153
PADEL_KR4154	NC(=O)c1ccc(Br)o1	PADEL_KR4154
PADEL_KR4155	NC(=O)c1ccc(cc1)[N+](=O)[O-]	PADEL_KR4155
PADEL_KR4156	NC(=O)c1ccc(cc1)c2ccccc2	PADEL_KR4156
PADEL_KR4157	NC(=O)c1ccc(cc1)N2C(=O)c3ccccc3C2=O	PADEL_KR4157
PADEL_KR4158	NC(=O)c1ccc(cc1C(=O)O)[N+](=O)[O-]	PADEL_KR4158
PADEL_KR4159	NC(=O)c1ccc(Cl)cc1	PADEL_KR4159
PADEL_KR4160	NC(=O)c1ccc(Cl)cc1Cl	PADEL_KR4160
PADEL_KR4161	NC(=O)c1ccc(F)c(F)c1	PADEL_KR4161
PADEL_KR4162	NC(=O)c1ccc(F)cc1	PADEL_KR4162
PADEL_KR4163	NC(=O)c1ccc(N)cc1	PADEL_KR4163
PADEL_KR4164	NC(=O)C1CCC=CC1	PADEL_KR4164
PADEL_KR4165	NC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccccc3	PADEL_KR4165
PADEL_KR4166	NC(=O)c1cccc(Br)c1	PADEL_KR4166
PADEL_KR4167	NC(=O)c1cccc(c1)[N+](=O)[O-]	PADEL_KR4167
PADEL_KR4168	NC(=O)c1cccc2ccccc12	PADEL_KR4168
PADEL_KR4169	NC(=O)C1CCCCC1	PADEL_KR4169
PADEL_KR4170	NC(=O)c1ccccc1[N+](=O)[O-]	PADEL_KR4170
PADEL_KR4171	NC(=O)c1ccccc1Br	PADEL_KR4171
PADEL_KR4172	NC(=O)c1ccccc1C(=O)O	PADEL_KR4172
PADEL_KR4173	NC(=O)c1ccccc1Cl	PADEL_KR4173
PADEL_KR4174	NC(=O)c1ccccc1F	PADEL_KR4174
PADEL_KR4175	NC(=O)c1cccnc1	PADEL_KR4175
PADEL_KR4176	NC(=O)c1ccco1	PADEL_KR4176
PADEL_KR4177	NC(=O)c1cccs1	PADEL_KR4177
PADEL_KR4178	NC(=O)c1ccncc1	PADEL_KR4178
PADEL_KR4179	NC(=O)c1csc2CCCCc12	PADEL_KR4179
PADEL_KR4180	NC(=O)c1nccnc1C(=O)O	PADEL_KR4180
PADEL_KR4181	NC(=O)CC(=O)N	PADEL_KR4181
PADEL_KR4182	NC(=O)CC=O	PADEL_KR4182
PADEL_KR4183	NC(=O)CCC(=O)O	PADEL_KR4183
PADEL_KR4184	NC(=O)CCC(=O)OCC(=C(Cl)Cl)Cl	PADEL_KR4184
PADEL_KR4185	NC(=O)CCCC(=O)O	PADEL_KR4185
PADEL_KR4186	NC(=O)CCCC(=O)OCC#C	PADEL_KR4186
PADEL_KR4187	NC(=O)CCCCCCC(=O)N	PADEL_KR4187
PADEL_KR4188	NC(=O)CCCO	PADEL_KR4188
PADEL_KR4189	NC(=O)CCl	PADEL_KR4189
PADEL_KR4190	NC(=O)CCNC(=O)C(F)(F)F	PADEL_KR4190
PADEL_KR4191	NC(=O)CO	PADEL_KR4191
PADEL_KR4192	NC(=O)CS	PADEL_KR4192
PADEL_KR4193	NC(=O)N	PADEL_KR4193
PADEL_KR4194	NC(=O)NC(=O)C(Cl)(Cl)Cl	PADEL_KR4194
PADEL_KR4195	NC(=O)NC(=O)N	PADEL_KR4195
PADEL_KR4196	NC(=O)NC(CC=O)C(Cl)(Cl)Cl	PADEL_KR4196
PADEL_KR4197	NC(=O)NC=O	PADEL_KR4197
PADEL_KR4198	NC(=O)NN=C	PADEL_KR4198
PADEL_KR4199	NC(=O)NN=C1C(=O)Nc2ccccc12	PADEL_KR4199
PADEL_KR4200	NC(=O)NN=Cc1ccccc1	PADEL_KR4200
PADEL_KR4201	NC(=O)NNC=O	PADEL_KR4201
PADEL_KR4202	NC(=O)NO	PADEL_KR4202
PADEL_KR4203	NC(=O)NS(=O)(=O)N	PADEL_KR4203
PADEL_KR4204	NC(=O)NS(=O)=O	PADEL_KR4204
PADEL_KR4205	NC(=O)O	PADEL_KR4205
PADEL_KR4206	NC(=O)OCCNS(=O)=O	PADEL_KR4206
PADEL_KR4207	NC(=O)ON=C	PADEL_KR4207
PADEL_KR4208	NC(=O)SCC=O	PADEL_KR4208
PADEL_KR4209	NC(=S)N	PADEL_KR4209
PADEL_KR4210	NC(=S)NC(=O)C=C	PADEL_KR4210
PADEL_KR4211	NC(=S)NC(=O)C=Cc1ccc(F)cc1	PADEL_KR4211
PADEL_KR4212	NC(=S)NC(=O)C=Cc1ccccc1	PADEL_KR4212
PADEL_KR4213	NC(=S)NC(=O)C=Cc1ccco1	PADEL_KR4213
PADEL_KR4214	NC(=S)NC(NC(=O)C=C)C(Cl)(Cl)Cl	PADEL_KR4214
PADEL_KR4215	NC(=S)NC(NC(=O)C=Cc1ccccc1)C(Cl)(Cl)Cl	PADEL_KR4215
PADEL_KR4216	NC(=S)NC(NC(=O)CF)C(Cl)(Cl)Cl	PADEL_KR4216
PADEL_KR4217	NC(=S)NC(NC=O)C(Cl)(Cl)Cl	PADEL_KR4217
PADEL_KR4218	NC(=S)NC=O	PADEL_KR4218
PADEL_KR4219	NC(=S)Nc1ccc(cc1)S(=O)=O	PADEL_KR4219
PADEL_KR4220	NC(=S)NCC=O	PADEL_KR4220
PADEL_KR4221	NC(=S)NN=C	PADEL_KR4221
PADEL_KR4222	NC(=S)NN=C1C(=O)Nc2ccccc12	PADEL_KR4222
PADEL_KR4223	NC(=S)NNC=O	PADEL_KR4223
PADEL_KR4224	NC(=S)SCC=O	PADEL_KR4224
PADEL_KR4225	NC(CO)CO	PADEL_KR4225
PADEL_KR4226	NC(NC(=O)CF)C(Cl)(Cl)Cl	PADEL_KR4226
PADEL_KR4227	NC(NC(=O)N)C(Cl)(Cl)Cl	PADEL_KR4227
PADEL_KR4228	NC(NC=O)C(Br)(Br)Br	PADEL_KR4228
PADEL_KR4229	NC(NC=O)C(Cl)(Cl)Cl	PADEL_KR4229
PADEL_KR4230	NC(NC=O)C=O	PADEL_KR4230
PADEL_KR4231	NC=C	PADEL_KR4231
PADEL_KR4232	NC=C1C(=O)CCCC1=O	PADEL_KR4232
PADEL_KR4233	NC=C1C(=O)CNC1=O	PADEL_KR4233
PADEL_KR4234	NC=C1C(=O)N(C(=O)c2ccccc12)c3ccccc3	PADEL_KR4234
PADEL_KR4235	NC=C1C(=O)NC(=O)NC1=O	PADEL_KR4235
PADEL_KR4236	NC=C1SC(=S)NC1=O	PADEL_KR4236
PADEL_KR4237	NC=O	PADEL_KR4237
PADEL_KR4238	NC=S	PADEL_KR4238
PADEL_KR4239	NC1=CC(=O)c2ccccc2C1=O	PADEL_KR4239
PADEL_KR4240	Nc1ccc([N+](=O)[O-])c2nonc12	PADEL_KR4240
PADEL_KR4241	Nc1ccc(Br)cc1	PADEL_KR4241
PADEL_KR4242	Nc1ccc(Br)cc1C=O	PADEL_KR4242
PADEL_KR4243	Nc1ccc(C=O)cc1	PADEL_KR4243
PADEL_KR4244	Nc1ccc(cc1)[N+](=O)[O-]	PADEL_KR4244
PADEL_KR4245	Nc1ccc(cc1)C(=O)O	PADEL_KR4245
PADEL_KR4246	Nc1ccc(cc1)S(=O)(=O)N	PADEL_KR4246
PADEL_KR4247	Nc1ccc(cc1)S(=O)=O	PADEL_KR4247
PADEL_KR4248	Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]	PADEL_KR4248
PADEL_KR4249	Nc1ccc(Cl)c(Cl)c1	PADEL_KR4249
PADEL_KR4250	Nc1ccc(Cl)cc1	PADEL_KR4250
PADEL_KR4251	Nc1ccc(Cl)cc1C=O	PADEL_KR4251
PADEL_KR4252	Nc1ccc(F)cc1	PADEL_KR4252
PADEL_KR4253	Nc1ccc(I)cc1	PADEL_KR4253
PADEL_KR4254	Nc1ccc(O)cc1	PADEL_KR4254
PADEL_KR4255	Nc1ccc2ccccc2c1	PADEL_KR4255
PADEL_KR4256	Nc1cccc(c1)[N+](=O)[O-]	PADEL_KR4256
PADEL_KR4257	Nc1cccc(c1)C(=O)O	PADEL_KR4257
PADEL_KR4258	Nc1cccc(c1)C(F)(F)F	PADEL_KR4258
PADEL_KR4259	Nc1cccc(Cl)c1	PADEL_KR4259
PADEL_KR4260	Nc1cccc(O)c1	PADEL_KR4260
PADEL_KR4261	NC1CCCC1	PADEL_KR4261
PADEL_KR4262	Nc1cccc2ccccc12	PADEL_KR4262
PADEL_KR4263	Nc1cccc2cccnc12	PADEL_KR4263
PADEL_KR4264	NC1CCCCC1	PADEL_KR4264
PADEL_KR4265	Nc1ccccc1[N+](=O)[O-]	PADEL_KR4265
PADEL_KR4266	Nc1ccccc1C(=O)O	PADEL_KR4266
PADEL_KR4267	Nc1ccccc1Cl	PADEL_KR4267
PADEL_KR4268	Nc1ccccc1O	PADEL_KR4268
PADEL_KR4269	Nc1ccccn1	PADEL_KR4269
PADEL_KR4270	Nc1cnc2ccccc2n1	PADEL_KR4270
PADEL_KR4271	Nc1cnon1	PADEL_KR4271
PADEL_KR4272	Nc1nc(Cl)nc(Cl)n1	PADEL_KR4272
PADEL_KR4273	Nc1nc(cs1)c2ccccc2	PADEL_KR4273
PADEL_KR4274	Nc1ncccn1	PADEL_KR4274
PADEL_KR4275	Nc1nccs1	PADEL_KR4275
PADEL_KR4276	Nc1ncn[nH]1	PADEL_KR4276
PADEL_KR4277	Nc1ncnc(Cl)n1	PADEL_KR4277
PADEL_KR4278	Nc1ncnc(n1)N2CCOCC2	PADEL_KR4278
PADEL_KR4279	Nc1ncncn1	PADEL_KR4279
PADEL_KR4280	Nc1nncs1	PADEL_KR4280
PADEL_KR4281	NCC(=O)N	PADEL_KR4281
PADEL_KR4282	NCC(=O)NN=C	PADEL_KR4282
PADEL_KR4283	NCC(=O)O	PADEL_KR4283
PADEL_KR4284	NCC(O)CO	PADEL_KR4284
PADEL_KR4285	NCC=C	PADEL_KR4285
PADEL_KR4286	NCC=O	PADEL_KR4286
PADEL_KR4287	NCc1ccccc1	PADEL_KR4287
PADEL_KR4288	NCc1ccco1	PADEL_KR4288
PADEL_KR4289	NCc1ccncc1	PADEL_KR4289
PADEL_KR4290	NCCC(=O)O	PADEL_KR4290
PADEL_KR4291	NCCC=O	PADEL_KR4291
PADEL_KR4292	NCCCC(=O)O	PADEL_KR4292
PADEL_KR4293	NCCCO	PADEL_KR4293
PADEL_KR4294	NCCN	PADEL_KR4294
PADEL_KR4295	NCCO	PADEL_KR4295
PADEL_KR4296	NCCS	PADEL_KR4296
PADEL_KR4297	NCN1C(=O)c2ccccc2C1=O	PADEL_KR4297
PADEL_KR4298	NCN1C(=O)CCC1=O	PADEL_KR4298
PADEL_KR4299	NCn1cnc2ccccc12	PADEL_KR4299
PADEL_KR4300	NCn1nnc2ccccc12	PADEL_KR4300
PADEL_KR4301	NN	PADEL_KR4301
PADEL_KR4302	NN=C	PADEL_KR4302
PADEL_KR4303	NN=C1C(=O)NC(=O)NC1=O	PADEL_KR4303
PADEL_KR4304	NN=C1C(=O)NC(=S)NC1=O	PADEL_KR4304
PADEL_KR4305	NN=C1C(=O)Nc2ccccc12	PADEL_KR4305
PADEL_KR4306	NN=C1C(C(=NN)c2ccccc12)c3ccccc3	PADEL_KR4306
PADEL_KR4307	NN=C1C=NN(C1=O)c2ccccc2	PADEL_KR4307
PADEL_KR4308	NN=C1C=NN(C1=O)c2nc(cs2)c3ccccc3	PADEL_KR4308
PADEL_KR4309	NN=C1C=NNC1=O	PADEL_KR4309
PADEL_KR4310	NN=CN=N	PADEL_KR4310
PADEL_KR4311	NN=N	PADEL_KR4311
PADEL_KR4312	Nn1cnnc1	PADEL_KR4312
PADEL_KR4313	NNC(=O)c1ccccc1	PADEL_KR4313
PADEL_KR4314	NNC(=O)CO	PADEL_KR4314
PADEL_KR4315	NNC(=O)N	PADEL_KR4315
PADEL_KR4316	NNC(=S)N	PADEL_KR4316
PADEL_KR4317	NNC=O	PADEL_KR4317
PADEL_KR4318	NNc1ccccc1	PADEL_KR4318
PADEL_KR4319	NNS(=O)=O	PADEL_KR4319
PADEL_KR4320	NS	PADEL_KR4320
PADEL_KR4321	NS(=O)(=O)c1ccc(Br)cc1	PADEL_KR4321
PADEL_KR4322	NS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]	PADEL_KR4322
PADEL_KR4323	NS(=O)(=O)c1ccc(cc1)c2ccccc2	PADEL_KR4323
PADEL_KR4324	NS(=O)(=O)c1ccc(Cl)cc1	PADEL_KR4324
PADEL_KR4325	NS(=O)(=O)c1cccc2nsnc12	PADEL_KR4325
PADEL_KR4326	NS(=O)(=O)c1ccccc1	PADEL_KR4326
PADEL_KR4327	NS(=O)(=O)c1ccccc1[N+](=O)[O-]	PADEL_KR4327
PADEL_KR4328	NS(=O)=O	PADEL_KR4328
PADEL_KR4329	NS=O	PADEL_KR4329
PADEL_KR4330	NS(c1ccccc1[N+](=O)[O-])	PADEL_KR4330
PADEL_KR4331	O	PADEL_KR4331
PADEL_KR4332	O[NH2]=O	PADEL_KR4332
PADEL_KR4333	O=[SH2]=O	PADEL_KR4333
PADEL_KR4334	O=C(C(=O)c1ccccc1)c2ccccc2	PADEL_KR4334
PADEL_KR4335	O=C(C=Cc1ccccc1)c2ccccc2	PADEL_KR4335
PADEL_KR4336	O=C(c1ccccc1)c2ccccc2	PADEL_KR4336
PADEL_KR4337	O=C(c1ccccc1)c2cnncc2	PADEL_KR4337
PADEL_KR4338	O=C(NN=Cc1ccccc1)c2ccccc2	PADEL_KR4338
PADEL_KR4339	O=C(NNC(=O)c1ccccc1)c2ccccc2	PADEL_KR4339
PADEL_KR4340	O=c1[nH][nH]c(=O)c2ccccc12	PADEL_KR4340
PADEL_KR4341	O=c1[nH]c(=O)[nH]c(=O)[nH]1	PADEL_KR4341
PADEL_KR4342	O=c1[nH]c(=O)c2[nH]cnc2[nH]1	PADEL_KR4342
PADEL_KR4343	O=c1[nH]c(=O)c2cc3c(=O)[nH]c(=O)c3cc12	PADEL_KR4343
PADEL_KR4344	O=c1[nH]c(=O)c2nc3ccccc3nc2[nH]1	PADEL_KR4344
PADEL_KR4345	O=c1[nH]c(nc2ccccc12)c3ccccc3	PADEL_KR4345
PADEL_KR4346	O=c1[nH]c2ccccc2[nH]1	PADEL_KR4346
PADEL_KR4347	O=c1[nH]c2ccccc2o1	PADEL_KR4347
PADEL_KR4348	O=c1[nH]cnc2ccccc12	PADEL_KR4348
PADEL_KR4349	O=c1[nH]cnc2n(cnc12)C3CCCO3	PADEL_KR4349
PADEL_KR4350	O=c1[nH]cnc2sc3CCCCc3c12	PADEL_KR4350
PADEL_KR4351	O=c1[nH]ncc2ccccc12	PADEL_KR4351
PADEL_KR4352	O=C1C(=Cc2ccccc12)c3ccccc3	PADEL_KR4352
PADEL_KR4353	O=C1C(C(=O)c2ccccc12)C3=CC(C(N=N3)c4ccccc4)c5ccccc5	PADEL_KR4353
PADEL_KR4354	O=C1C(C(=O)c2ccccc12)c3ccccc3	PADEL_KR4354
PADEL_KR4355	O=c1c(coc2ccccc12)c3ccc4OCCOc4c3	PADEL_KR4355
PADEL_KR4356	O=c1c(coc2ccccc12)c3ccccc3	PADEL_KR4356
PADEL_KR4357	O=c1c(coc2ccccc12)c3nc4ccccc4[nH]3	PADEL_KR4357
PADEL_KR4358	O=C1C=C(C(=O)c2ccccc12)c3ccccc3	PADEL_KR4358
PADEL_KR4359	O=C1C=CC(=O)C=C1	PADEL_KR4359
PADEL_KR4360	O=C1C=CC(=O)c2ccccc12	PADEL_KR4360
PADEL_KR4361	O=C1C=CC(=O)N1c2ccccc2	PADEL_KR4361
PADEL_KR4362	O=C1C2C(C(C=CC2c3ccccc3)c4ccccc4)C(=O)N1c5ccccc5	PADEL_KR4362
PADEL_KR4363	O=C1C2C(C3C=CC2C4C3C(=O)N(C4=O)c5ccccc5)C(=O)N1c6ccccc6	PADEL_KR4363
PADEL_KR4364	O=C1C2C(C3c4ccccc4C2c5ccccc35)C(=O)N1c6ccccc6	PADEL_KR4364
PADEL_KR4365	O=C1C2C3CC(C=C3)C2C(=O)N1c4ccccc4	PADEL_KR4365
PADEL_KR4366	O=C1C2C3OC(C=C3)C2C(=O)N1c4ccccc4	PADEL_KR4366
PADEL_KR4367	O=c1c2cccc3cccc(c4nc5ccccc5n14)c32	PADEL_KR4367
PADEL_KR4368	O=C1c2ccccc2C(=O)c3ccccc13	PADEL_KR4368
PADEL_KR4369	O=C1c2ccccc2C(c3ccccc3)(c4ccccc4)c5ccccc15	PADEL_KR4369
PADEL_KR4370	O=C1c2ccccc2-c3ccccc13	PADEL_KR4370
PADEL_KR4371	O=C1c2ccccc2-c3ncnc4cccc1c34	PADEL_KR4371
PADEL_KR4372	O=C1C2CN3CC1CN(C2)C3	PADEL_KR4372
PADEL_KR4373	O=C1CC(=O)c2ccccc12	PADEL_KR4373
PADEL_KR4374	O=C1CC(=O)NC(=O)N1	PADEL_KR4374
PADEL_KR4375	O=C1CC(CN1)c2ccccc2	PADEL_KR4375
PADEL_KR4376	O=C1CC(N2CCCC2)C(=O)N1c3ccccc3	PADEL_KR4376
PADEL_KR4377	O=C1CC(N2CCCCC2)C(=O)N1c3ccccc3	PADEL_KR4377
PADEL_KR4378	O=C1CC(N2CCN(CC2)C3CC(=O)N(C3=O)c4ccccc4)C(=O)N1c5ccccc5	PADEL_KR4378
PADEL_KR4379	O=C1CC(N2CCN(CC2)c3ccccc3)C(=O)N1c4ccccc4	PADEL_KR4379
PADEL_KR4380	O=C1CC(N2CCN(CC2)c3ncccn3)C(=O)N1c4ccccc4	PADEL_KR4380
PADEL_KR4381	O=C1CC(N2CCNCC2)C(=O)N1c3ccccc3	PADEL_KR4381
PADEL_KR4382	O=C1CC(N2CCOCC2)C(=O)N1c3ccccc3	PADEL_KR4382
PADEL_KR4383	O=c1cc[nH]c(=O)[nH]1	PADEL_KR4383
PADEL_KR4384	O=c1cc[nH]cn1	PADEL_KR4384
PADEL_KR4385	O=c1cc[nH]n1c2ccccc2	PADEL_KR4385
PADEL_KR4386	O=C1CC=NN1c2ccccc2	PADEL_KR4386
PADEL_KR4387	O=C1Cc2ccccc2N1	PADEL_KR4387
PADEL_KR4388	O=C1CCC(=O)N1	PADEL_KR4388
PADEL_KR4389	O=C1CCC(=O)N1c2cccc3ccccc23	PADEL_KR4389
PADEL_KR4390	O=C1CCC(=O)N1c2ccccc2	PADEL_KR4390
PADEL_KR4391	O=C1CCC(O1)c2ccccc2	PADEL_KR4391
PADEL_KR4392	O=c1ccc2c(c3ccccc3)c4ccccc4oc2c1	PADEL_KR4392
PADEL_KR4393	O=c1ccc2ccccc2[nH]1	PADEL_KR4393
PADEL_KR4394	O=c1ccc2ccccc2o1	PADEL_KR4394
PADEL_KR4395	O=c1ccc2ccccc2s1	PADEL_KR4395
PADEL_KR4396	O=C1CCCC(=O)C1	PADEL_KR4396
PADEL_KR4397	O=c1cccc[nH]1	PADEL_KR4397
PADEL_KR4398	O=C1CCCC=C1	PADEL_KR4398
PADEL_KR4399	O=C1CCCC1	PADEL_KR4399
PADEL_KR4400	O=C1CCCc2[nH]ncc12	PADEL_KR4400
PADEL_KR4401	O=C1CCCC2=C1C(C=CN2)c3ccccc3	PADEL_KR4401
PADEL_KR4402	O=C1CCCC2=C1C(C=CO2)c3ccccc3	PADEL_KR4402
PADEL_KR4403	O=C1CCCC2=C1C(Nc3ccc4ccccc4c23)c5ccccc5	PADEL_KR4403
PADEL_KR4404	O=C1CCCC2=C1C(Nc3ccc4ncccc4c23)c5ccccc5	PADEL_KR4404
PADEL_KR4405	O=C1CCCc2c1[nH]c3ccccc23	PADEL_KR4405
PADEL_KR4406	O=C1CCCc2ccsc12	PADEL_KR4406
PADEL_KR4407	O=C1CCCc2nc3ccccc3cc12	PADEL_KR4407
PADEL_KR4408	O=C1CCCCC1	PADEL_KR4408
PADEL_KR4409	O=C1CCCCCN1	PADEL_KR4409
PADEL_KR4410	O=c1cccco1	PADEL_KR4410
PADEL_KR4411	O=C1CCCN1	PADEL_KR4411
PADEL_KR4412	O=C1CCCN1c2ccccc2	PADEL_KR4412
PADEL_KR4413	O=C1CCCO1	PADEL_KR4413
PADEL_KR4414	O=c1ccn(C2CCCO2)c(=O)[nH]1	PADEL_KR4414
PADEL_KR4415	O=C1CCN2C(=C1)Nc3ccccc23	PADEL_KR4415
PADEL_KR4416	O=c1ccnc[nH]1	PADEL_KR4416
PADEL_KR4417	O=c1ccnc2ccccn12	PADEL_KR4417
PADEL_KR4418	O=c1ccoc2ccccc12	PADEL_KR4418
PADEL_KR4419	O=c1cn[nH]c(=O)[nH]1	PADEL_KR4419
PADEL_KR4420	O=c1cn[nH]c(=S)[nH]1	PADEL_KR4420
PADEL_KR4421	O=c1cnc2ccccc2[nH]1	PADEL_KR4421
PADEL_KR4422	O=C1CNc2ccccc2N1	PADEL_KR4422
PADEL_KR4423	O=C1CNCC(=O)N1	PADEL_KR4423
PADEL_KR4424	O=C1CSC(=S)N1	PADEL_KR4424
PADEL_KR4425	O=C1CSC(N1)c2ccccc2	PADEL_KR4425
PADEL_KR4426	O=C1CS(c2ccccc12)	PADEL_KR4426
PADEL_KR4427	O=C1CS(c2ccccc2N1)	PADEL_KR4427
PADEL_KR4428	O=C1N(C(=O)c2cccc3cccc1c23)c4ccccc4	PADEL_KR4428
PADEL_KR4429	O=C1N(C(=O)c2ccccc12)c3ccccc3	PADEL_KR4429
PADEL_KR4430	O=c1n(c2ccccc2)c(=O)c3cc4c(=O)n(c5ccccc5)c(=O)c4cc13	PADEL_KR4430
PADEL_KR4431	O=c1n(cnc2ccccc12)c3ccccc3	PADEL_KR4431
PADEL_KR4432	O=C1NC(=O)C=C1	PADEL_KR4432
PADEL_KR4433	O=C1NC(=O)C2(CCCCC2)N1	PADEL_KR4433
PADEL_KR4434	O=C1NC(=O)C2C1C3C=CC2C4C3C(=O)NC4=O	PADEL_KR4434
PADEL_KR4435	O=C1NC(=O)C2C1C3c4ccccc4C2c5ccccc35	PADEL_KR4435
PADEL_KR4436	O=C1NC(=O)C2C3CC(C=C3)C21	PADEL_KR4436
PADEL_KR4437	O=C1NC(=O)C2C3OC(C=C3)C21	PADEL_KR4437
PADEL_KR4438	O=C1NC(=O)c2ccc(N3CCOCC3)c4cccc1c24	PADEL_KR4438
PADEL_KR4439	O=C1NC(=O)c2cccc3cccc1c23	PADEL_KR4439
PADEL_KR4440	O=C1NC(=O)c2ccccc12	PADEL_KR4440
PADEL_KR4441	O=C1NC(=S)SC1=C2C(=O)Nc3ccccc23	PADEL_KR4441
PADEL_KR4442	O=C1NC(=S)SC1=C2Nc3ccccc3S2	PADEL_KR4442
PADEL_KR4443	O=C1NC(=S)SC1=C2SC(=S)NC2=O	PADEL_KR4443
PADEL_KR4444	O=C1NC(=S)SC1=Cc2ccccc2	PADEL_KR4444
PADEL_KR4445	O=C1NC(c2ccccc12)(c3ccccc3)c4ccccc4	PADEL_KR4445
PADEL_KR4446	O=c1nc[nH]c2ccccc12	PADEL_KR4446
PADEL_KR4447	O=C1NC=CC(N1)c2ccccc2	PADEL_KR4447
PADEL_KR4448	O=C1Nc2cccc3cccc1c23	PADEL_KR4448
PADEL_KR4449	O=C1Nc2ccccc2C1=C3SC(=S)N(C3=O)c4ccccc4	PADEL_KR4449
PADEL_KR4450	O=C1Nc2ccccc2C1=O	PADEL_KR4450
PADEL_KR4451	O=C1NC2NC(=O)NC2N1	PADEL_KR4451
PADEL_KR4452	O=C1NCc2ccccc12	PADEL_KR4452
PADEL_KR4453	O=c1nccc[nH]1	PADEL_KR4453
PADEL_KR4454	O=C1NCCc2c1[nH]c3ccccc23	PADEL_KR4454
PADEL_KR4455	O=c1ncccn1c2ccccc2	PADEL_KR4455
PADEL_KR4456	O=C1NCCN1c2cccc3ccccc23	PADEL_KR4456
PADEL_KR4457	O=C1NCCN1c2ccccc2	PADEL_KR4457
PADEL_KR4458	O=C1NN=C(CC1c2c[nH]c3ccccc23)c4ccccc4	PADEL_KR4458
PADEL_KR4459	O=C1OC(=O)c2ccccc12	PADEL_KR4459
PADEL_KR4460	O=C1OC(c2ccccc12)(c3ccccc3)c4ccccc4	PADEL_KR4460
PADEL_KR4461	O=c1oc(nc2ccccc12)c3ccccc3	PADEL_KR4461
PADEL_KR4462	O=C1OC2(CCCCC2)C=C1	PADEL_KR4462
PADEL_KR4463	O=c1oc2ccccc2c3[nH]nnc13	PADEL_KR4463
PADEL_KR4464	O=C1OCc2ccccc12	PADEL_KR4464
PADEL_KR4465	O=c1occcc1C2=Nc3ccccc3SC(C2)c4ccccc4	PADEL_KR4465
PADEL_KR4466	O=c1occcc1C2=NCCSC(C2)c3ccccc3	PADEL_KR4466
PADEL_KR4467	O=c1ocnc2ccccc12	PADEL_KR4467
PADEL_KR4468	O=CC(=O)c1ccccc1	PADEL_KR4468
PADEL_KR4469	O=CC(C=O)C1CCCCC1	PADEL_KR4469
PADEL_KR4470	O=CC(c1ccccc1)c2ccccc2	PADEL_KR4470
PADEL_KR4471	O=CC(Cc1ccccc1)C=O	PADEL_KR4471
PADEL_KR4472	O=CC=O	PADEL_KR4472
PADEL_KR4473	O=CC1(CC2CC3C1)CC(C2)CC3	PADEL_KR4473
PADEL_KR4474	O=CC1(CC2CC3CC(C2)C1)C3	PADEL_KR4474
PADEL_KR4475	O=CC1C(C=O)C2c3ccccc3C1c4ccccc24	PADEL_KR4475
PADEL_KR4476	O=CC1C(C=O)N2C(C(C=O)C(C=O)N2C1c3ccccc3)c4ccccc4	PADEL_KR4476
PADEL_KR4477	O=Cc1c[nH]c2nc3ccccc3nc12	PADEL_KR4477
PADEL_KR4478	O=CC1C2CCCCC12	PADEL_KR4478
PADEL_KR4479	O=CC1CC1	PADEL_KR4479
PADEL_KR4480	O=CC1CC1(c2ccccc2)c3ccccc3	PADEL_KR4480
PADEL_KR4481	O=CC1CC1c2ccccc2	PADEL_KR4481
PADEL_KR4482	O=CC1CC21CCC2	PADEL_KR4482
PADEL_KR4483	O=Cc1cc2ccccc2oc1=O	PADEL_KR4483
PADEL_KR4484	O=Cc1ccc(C=O)c(C=O)c1	PADEL_KR4484
PADEL_KR4485	O=Cc1ccc(C=O)cc1	PADEL_KR4485
PADEL_KR4486	O=Cc1ccc(cc1)c2ccccc2	PADEL_KR4486
PADEL_KR4487	O=Cc1ccc(cc1)S(=O)=O	PADEL_KR4487
PADEL_KR4488	O=Cc1ccc(cc1C=O)C(=O)c2ccc(C=O)c(C=O)c2	PADEL_KR4488
PADEL_KR4489	O=Cc1ccc2ccccc2c1	PADEL_KR4489
PADEL_KR4490	O=Cc1cccc(C=O)c1	PADEL_KR4490
PADEL_KR4491	O=Cc1cccc(c1)S(=O)=O	PADEL_KR4491
PADEL_KR4492	O=CC1CCCC1	PADEL_KR4492
PADEL_KR4493	O=Cc1cccc2cccc(C=O)c12	PADEL_KR4493
PADEL_KR4494	O=Cc1cccc2ccccc12	PADEL_KR4494
PADEL_KR4495	O=CC1CCCCC1	PADEL_KR4495
PADEL_KR4496	O=Cc1ccccc1C=O	PADEL_KR4496
PADEL_KR4497	O=Cc1ccccc1S(=O)=O	PADEL_KR4497
PADEL_KR4498	O=Cc1ccccn1	PADEL_KR4498
PADEL_KR4499	O=Cc1cccnc1	PADEL_KR4499
PADEL_KR4500	O=Cc1ccco1	PADEL_KR4500
PADEL_KR4501	O=Cc1cccs1	PADEL_KR4501
PADEL_KR4502	O=Cc1ccn[nH]1	PADEL_KR4502
PADEL_KR4503	O=Cc1ccncc1	PADEL_KR4503
PADEL_KR4504	O=Cc1ccsc1	PADEL_KR4504
PADEL_KR4505	O=Cc1cn[nH]c1	PADEL_KR4505
PADEL_KR4506	O=Cc1cncs1	PADEL_KR4506
PADEL_KR4507	O=Cc1csc2C(=O)CCCc12	PADEL_KR4507
PADEL_KR4508	O=Cc1csc2CCCCc12	PADEL_KR4508
PADEL_KR4509	O=CCC#N	PADEL_KR4509
PADEL_KR4510	O=CCC(NC=O)c1ccccc1	PADEL_KR4510
PADEL_KR4511	O=CCC(S(c1ccccc1))C=O	PADEL_KR4511
PADEL_KR4512	O=CCC=O	PADEL_KR4512
PADEL_KR4513	O=CCC1(C(=O)c2ccccc2C1=O)c3ccccc3	PADEL_KR4513
PADEL_KR4514	O=CCC1(CC2CC3CC(C2)C1)C3	PADEL_KR4514
PADEL_KR4515	O=CCc1cccc2ccccc12	PADEL_KR4515
PADEL_KR4516	O=CCc1ccccc1	PADEL_KR4516
PADEL_KR4517	O=CCc1ccccc1C=O	PADEL_KR4517
PADEL_KR4518	O=CCCC(=O)OCC=O	PADEL_KR4518
PADEL_KR4519	O=CCCC=O	PADEL_KR4519
PADEL_KR4520	O=CCCc1c[nH]c2ccccc12	PADEL_KR4520
PADEL_KR4521	O=CCCc1ccccc1	PADEL_KR4521
PADEL_KR4522	O=CCCCC=O	PADEL_KR4522
PADEL_KR4523	O=CCCCc1ccccc1	PADEL_KR4523
PADEL_KR4524	O=CCCCCC=O	PADEL_KR4524
PADEL_KR4525	O=CCCCCCCC=O	PADEL_KR4525
PADEL_KR4526	O=CCCCNC(=S)SCC=O	PADEL_KR4526
PADEL_KR4527	O=CCCNC(=S)SCC=O	PADEL_KR4527
PADEL_KR4528	O=CCn1ccc(=NCc2ccccc2)cc1	PADEL_KR4528
PADEL_KR4529	O=CCNC(=O)SCC=O	PADEL_KR4529
PADEL_KR4530	O=CCNC(=S)SCC=O	PADEL_KR4530
PADEL_KR4531	O=CCNC=O	PADEL_KR4531
PADEL_KR4532	O=CCOC(=O)CCS(=O)=O	PADEL_KR4532
PADEL_KR4533	O=CCOC=O	PADEL_KR4533
PADEL_KR4534	O=CCSC(=S)Nc1ccccc1	PADEL_KR4534
PADEL_KR4535	O=CCSC(=S)NCc1ccccc1	PADEL_KR4535
PADEL_KR4536	O=CCSC(CC=O)C=O	PADEL_KR4536
PADEL_KR4537	O=CN1CCc2ccccc12	PADEL_KR4537
PADEL_KR4538	O=CN1CCCC1	PADEL_KR4538
PADEL_KR4539	O=CN1CCCCC1	PADEL_KR4539
PADEL_KR4540	O=CN1CCCCCC1	PADEL_KR4540
PADEL_KR4541	O=CN1CCNCC1	PADEL_KR4541
PADEL_KR4542	O=CN1CCOCC1	PADEL_KR4542
PADEL_KR4543	O=Cn1cnc2ccccc12	PADEL_KR4543
PADEL_KR4544	O=Cn1nnc2ccccc12	PADEL_KR4544
PADEL_KR4545	O=CNC=S	PADEL_KR4545
PADEL_KR4546	O=CNc1cc2CCCCc2s1	PADEL_KR4546
PADEL_KR4547	O=CNc1ccc(cc1)S(=O)=O	PADEL_KR4547
PADEL_KR4548	O=CNc1ccc(CCc2ccccc2)cc1	PADEL_KR4548
PADEL_KR4549	O=CNc1ccc(S(c2ccccc2))cc1	PADEL_KR4549
PADEL_KR4550	O=CNc1ccc2ccccc2c1	PADEL_KR4550
PADEL_KR4551	O=CNc1cccc2ccccc12	PADEL_KR4551
PADEL_KR4552	O=CNC1CCCCC1	PADEL_KR4552
PADEL_KR4553	O=CNc1ccccc1c2nc3ccccc3s2	PADEL_KR4553
PADEL_KR4554	O=CNc1nc2ccccc2s1	PADEL_KR4554
PADEL_KR4555	O=CNCCCCCCNC=O	PADEL_KR4555
PADEL_KR4556	O=CNCCCCNC=O	PADEL_KR4556
PADEL_KR4557	O=CNCCNC=O	PADEL_KR4557
PADEL_KR4558	O=CNCCOC=O	PADEL_KR4558
PADEL_KR4559	O=CNCNC=O	PADEL_KR4559
PADEL_KR4560	O=CNCOC=O	PADEL_KR4560
PADEL_KR4561	O=CNN=C1C(=O)Nc2ccccc12	PADEL_KR4561
PADEL_KR4562	O=CNN=C1CCCC1	PADEL_KR4562
PADEL_KR4563	O=CNN=C1CCCCC1	PADEL_KR4563
PADEL_KR4564	O=CNN=CC=Cc1ccccc1	PADEL_KR4564
PADEL_KR4565	O=CNN=CC=NNC=O	PADEL_KR4565
PADEL_KR4566	O=CNN=Cc1c[nH]c2ccccc12	PADEL_KR4566
PADEL_KR4567	O=CNN=Cc1ccc(cc1)c2ccccc2	PADEL_KR4567
PADEL_KR4568	O=CNN=Cc1ccc[nH]1	PADEL_KR4568
PADEL_KR4569	O=CNN=Cc1ccc2OCOc2c1	PADEL_KR4569
PADEL_KR4570	O=CNN=Cc1cccc2ccccc12	PADEL_KR4570
PADEL_KR4571	O=CNN=Cc1ccccc1	PADEL_KR4571
PADEL_KR4572	O=CNN=Cc1cccnc1	PADEL_KR4572
PADEL_KR4573	O=CNN=Cc1ccco1	PADEL_KR4573
PADEL_KR4574	O=CNN=Cc1cccs1	PADEL_KR4574
PADEL_KR4575	O=CNN=Cc1ccncc1	PADEL_KR4575
PADEL_KR4576	O=CNN=Cc1nc2ccccc2[nH]1	PADEL_KR4576
PADEL_KR4577	O=CNn1cnnc1	PADEL_KR4577
PADEL_KR4578	O=CNNC(=S)NC=O	PADEL_KR4578
PADEL_KR4579	O=CNNC=O	PADEL_KR4579
PADEL_KR4580	O=CNNS(=O)=O	PADEL_KR4580
PADEL_KR4581	O=CNS(=O)=O	PADEL_KR4581
PADEL_KR4582	O=COc1ccc2ccccc2c1	PADEL_KR4582
PADEL_KR4583	O=COc1ccccc1	PADEL_KR4583
PADEL_KR4584	O=COCC#C	PADEL_KR4584
PADEL_KR4585	O=P1OCCCO1	PADEL_KR4585
PADEL_KR4586	O=S(=O)(c1ccccc1)c2ccccc2	PADEL_KR4586
PADEL_KR4587	O=S(=O)c1ccc(cc1)C2CCCCC2	PADEL_KR4587
PADEL_KR4588	O=S(=O)c1ccc(S(c2ccc(cc2)S(=O)=O))cc1	PADEL_KR4588
PADEL_KR4589	O=S(=O)c1ccc2ccccc2c1	PADEL_KR4589
PADEL_KR4590	O=S(=O)c1cccc2nsnc12	PADEL_KR4590
PADEL_KR4591	O=S(=O)c1ccccc1	PADEL_KR4591
PADEL_KR4592	O=S(=O)C1CCS(=O)(=O)C1	PADEL_KR4592
PADEL_KR4593	O=S(=O)N1CCCCC1	PADEL_KR4593
PADEL_KR4594	O=S(=O)N1CCNCC1	PADEL_KR4594
PADEL_KR4595	O=S(=O)N1CCOCC1	PADEL_KR4595
PADEL_KR4596	O=S(=O)n1cnc2ccccc12	PADEL_KR4596
PADEL_KR4597	O=S(=O)Nc1cccc2cccnc12	PADEL_KR4597
PADEL_KR4598	O=S(=O)NC1CCCCC1	PADEL_KR4598
PADEL_KR4599	O=S(=O)Nc1ccccn1	PADEL_KR4599
PADEL_KR4600	O=S(=O)Nc1cnc2ccccc2n1	PADEL_KR4600
PADEL_KR4601	O=S(=O)Nc1nccs1	PADEL_KR4601
PADEL_KR4602	O=S(=O)Oc1ccccc1	PADEL_KR4602
PADEL_KR4603	O=S1(=O)c2ccccc2-c3ccccc31	PADEL_KR4603
PADEL_KR4604	O=S1(=O)CC(CS(=O)(=O)C1)c2ccccc2	PADEL_KR4604
PADEL_KR4605	O=S1(=O)CCC=C1	PADEL_KR4605
PADEL_KR4606	O=S1(=O)CCCC1	PADEL_KR4606
PADEL_KR4607	O1C=CC(c2cn[nH]c12)c3ccccc3	PADEL_KR4607
PADEL_KR4608	OC(=O)C(F)(F)F	PADEL_KR4608
PADEL_KR4609	OC(=O)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F	PADEL_KR4609
PADEL_KR4610	OC(=O)C=C	PADEL_KR4610
PADEL_KR4611	OC(=O)C=CC(=O)NNC=O	PADEL_KR4611
PADEL_KR4612	OC(=O)C=Cc1ccccc1	PADEL_KR4612
PADEL_KR4613	OC(=O)C1(CC2CC3CC(C2)C1)C3	PADEL_KR4613
PADEL_KR4614	OC(=O)C1C(C=O)C2c3ccccc3C1c4ccccc24	PADEL_KR4614
PADEL_KR4615	OC(=O)C1C2CCCCC12	PADEL_KR4615
PADEL_KR4616	OC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]	PADEL_KR4616
PADEL_KR4617	OC(=O)c1cc(ccc1C=O)[N+](=O)[O-]	PADEL_KR4617
PADEL_KR4618	OC(=O)C1CC1c2ccccc2	PADEL_KR4618
PADEL_KR4619	OC(=O)C1CC2c3ccccc3C1c4ccccc24	PADEL_KR4619
PADEL_KR4620	OC(=O)C1CC2CC1C=C2	PADEL_KR4620
PADEL_KR4621	OC(=O)c1cc2ccccc2[nH]1	PADEL_KR4621
PADEL_KR4622	OC(=O)c1ccc(C=O)c(C=O)c1	PADEL_KR4622
PADEL_KR4623	OC(=O)c1ccc(C=O)cc1	PADEL_KR4623
PADEL_KR4624	OC(=O)c1ccc(cc1)[N+](=O)[O-]	PADEL_KR4624
PADEL_KR4625	OC(=O)c1ccc(cc1)C(=O)O	PADEL_KR4625
PADEL_KR4626	OC(=O)c1ccc(cc1)c2ccccc2	PADEL_KR4626
PADEL_KR4627	OC(=O)c1ccc(cc1)S(=O)=O	PADEL_KR4627
PADEL_KR4628	OC(=O)c1ccc(Cl)cc1	PADEL_KR4628
PADEL_KR4629	OC(=O)c1ccc(Cl)cc1Cl	PADEL_KR4629
PADEL_KR4630	OC(=O)c1ccc(NC(=S)NCC(Cl)(Cl)Cl)cc1	PADEL_KR4630
PADEL_KR4631	OC(=O)c1ccc(NC(=S)SCC=O)cc1	PADEL_KR4631
PADEL_KR4632	OC(=O)c1ccc(NC=O)cc1	PADEL_KR4632
PADEL_KR4633	OC(=O)c1ccc(O)cc1	PADEL_KR4633
PADEL_KR4634	OC(=O)c1ccc(O)cc1C(=O)O	PADEL_KR4634
PADEL_KR4635	OC(=O)C1CCC=CC1	PADEL_KR4635
PADEL_KR4636	OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c3ccccc3	PADEL_KR4636
PADEL_KR4637	OC(=O)c1cccc([N+](=O)[O-])c1C=O	PADEL_KR4637
PADEL_KR4638	OC(=O)c1cccc(Br)c1	PADEL_KR4638
PADEL_KR4639	OC(=O)c1cccc(c1)[N+](=O)[O-]	PADEL_KR4639
PADEL_KR4640	OC(=O)c1cccc(c1)C(=O)O	PADEL_KR4640
PADEL_KR4641	OC(=O)c1cccc(NC(=S)NCC(Cl)(Cl)Cl)c1	PADEL_KR4641
PADEL_KR4642	OC(=O)c1cccc(NC=O)c1	PADEL_KR4642
PADEL_KR4643	OC(=O)c1cccc(NS(=O)=O)c1	PADEL_KR4643
PADEL_KR4644	OC(=O)c1cccc2ccccc12	PADEL_KR4644
PADEL_KR4645	OC(=O)c1ccccc1	PADEL_KR4645
PADEL_KR4646	OC(=O)c1ccccc1C(=O)O	PADEL_KR4646
PADEL_KR4647	OC(=O)c1ccccc1C=O	PADEL_KR4647
PADEL_KR4648	OC(=O)c1ccccc1NC(=S)NCC(Cl)(Cl)Cl	PADEL_KR4648
PADEL_KR4649	OC(=O)c1ccccc1NC=O	PADEL_KR4649
PADEL_KR4650	OC(=O)c1ccccc1O	PADEL_KR4650
PADEL_KR4651	OC(=O)C1CCCN1	PADEL_KR4651
PADEL_KR4652	OC(=O)c1ccco1	PADEL_KR4652
PADEL_KR4653	OC(=O)c1cccs1	PADEL_KR4653
PADEL_KR4654	OC(=O)c1cnccn1	PADEL_KR4654
PADEL_KR4655	OC(=O)c1csc2CCCCc12	PADEL_KR4655
PADEL_KR4656	OC(=O)c1nccnc1C=O	PADEL_KR4656
PADEL_KR4657	OC(=O)CC(=O)O	PADEL_KR4657
PADEL_KR4658	OC(=O)CC1(CC2CC3CC(C2)C1)C3	PADEL_KR4658
PADEL_KR4659	OC(=O)Cc1ccccc1	PADEL_KR4659
PADEL_KR4660	OC(=O)CCC(=O)NNC=O	PADEL_KR4660
PADEL_KR4661	OC(=O)CCC(=O)O	PADEL_KR4661
PADEL_KR4662	OC(=O)CCC=NNC=O	PADEL_KR4662
PADEL_KR4663	OC(=O)CCC=O	PADEL_KR4663
PADEL_KR4664	OC(=O)CCc1c[nH]c2ccccc12	PADEL_KR4664
PADEL_KR4665	OC(=O)CCc1ccccc1	PADEL_KR4665
PADEL_KR4666	OC(=O)CCCC(=O)O	PADEL_KR4666
PADEL_KR4667	OC(=O)CCCC=O	PADEL_KR4667
PADEL_KR4668	OC(=O)CCCCC=O	PADEL_KR4668
PADEL_KR4669	OC(=O)CCCCCNC=O	PADEL_KR4669
PADEL_KR4670	OC(=O)CCCCCNS(=O)=O	PADEL_KR4670
PADEL_KR4671	OC(=O)CCCNC=O	PADEL_KR4671
PADEL_KR4672	OC(=O)CCCNS(=O)=O	PADEL_KR4672
PADEL_KR4673	OC(=O)CCNC(=S)SCC=O	PADEL_KR4673
PADEL_KR4674	OC(=O)CCNC=O	PADEL_KR4674
PADEL_KR4675	OC(=O)CCNS(=O)=O	PADEL_KR4675
PADEL_KR4676	OC(=O)CCS(=O)=O	PADEL_KR4676
PADEL_KR4677	OC(=O)CNC(=S)SCC=O	PADEL_KR4677
PADEL_KR4678	OC(=O)CNC=O	PADEL_KR4678
PADEL_KR4679	OC(=O)CNCC(=O)O	PADEL_KR4679
PADEL_KR4680	OC(=O)CNS(=O)=O	PADEL_KR4680
PADEL_KR4681	OC(=O)CS	PADEL_KR4681
PADEL_KR4682	OC(=O)CS(=O)=O	PADEL_KR4682
PADEL_KR4683	OC(=O)CSC(CC=O)C=O	PADEL_KR4683
PADEL_KR4684	OC(=O)NC(=O)CCBr	PADEL_KR4684
PADEL_KR4685	OC(C(F)(F)F)C(F)(F)F	PADEL_KR4685
PADEL_KR4686	OC(C=O)(c1ccc(Br)cc1)c2ccc(Br)cc2	PADEL_KR4686
PADEL_KR4687	OC(C=O)(c1ccccc1)C(F)(F)F	PADEL_KR4687
PADEL_KR4688	OC(C=O)(c1ccccc1)c2ccccc2	PADEL_KR4688
PADEL_KR4689	OC(CC=C)CC=C	PADEL_KR4689
PADEL_KR4690	OC(F)(F)C(F)Cl	PADEL_KR4690
PADEL_KR4691	OC(F)(F)C(F)F	PADEL_KR4691
PADEL_KR4692	OC(F)F	PADEL_KR4692
PADEL_KR4693	OC(NC=O)C(Br)(Br)Br	PADEL_KR4693
PADEL_KR4694	OC(NC=O)C(Cl)(Cl)Cl	PADEL_KR4694
PADEL_KR4695	OC=O	PADEL_KR4695
PADEL_KR4696	OC1(CC2CC3CC(C2)C1)C3	PADEL_KR4696
PADEL_KR4697	OC1C(=O)Nc2ccccc12	PADEL_KR4697
PADEL_KR4698	Oc1c(Br)cccc1Br	PADEL_KR4698
PADEL_KR4699	Oc1c(C=O)c(=O)oc2ccccc12	PADEL_KR4699
PADEL_KR4700	Oc1c(CC=C)cccc1C=NNC=O	PADEL_KR4700
PADEL_KR4701	Oc1c(Cl)cc(Cl)cc1C=N	PADEL_KR4701
PADEL_KR4702	Oc1c(F)c(F)c(O)c(F)c1F	PADEL_KR4702
PADEL_KR4703	Oc1c(F)c(F)cc(F)c1F	PADEL_KR4703
PADEL_KR4704	Oc1cc(=O)[nH]cn1	PADEL_KR4704
PADEL_KR4705	Oc1cc(=O)oc2ccccc12	PADEL_KR4705
PADEL_KR4706	Oc1cc(=O)sc2ccccc12	PADEL_KR4706
PADEL_KR4707	Oc1cc(cc2ccccc12)S(=O)(=O)O	PADEL_KR4707
PADEL_KR4708	Oc1cc(O)cc(O)c1	PADEL_KR4708
PADEL_KR4709	Oc1ccc(Br)cc1	PADEL_KR4709
PADEL_KR4710	Oc1ccc(Br)cc1Br	PADEL_KR4710
PADEL_KR4711	Oc1ccc(Br)cc1C=N	PADEL_KR4711
PADEL_KR4712	Oc1ccc(C=N)c(O)c1	PADEL_KR4712
PADEL_KR4713	Oc1ccc(C=N)cc1	PADEL_KR4713
PADEL_KR4714	Oc1ccc(C=N)cc1O	PADEL_KR4714
PADEL_KR4715	Oc1ccc(C=NNC=O)c(O)c1	PADEL_KR4715
PADEL_KR4716	Oc1ccc(C=NNC=O)cc1	PADEL_KR4716
PADEL_KR4717	Oc1ccc(C=O)cc1	PADEL_KR4717
PADEL_KR4718	Oc1ccc(C=O)cc1O	PADEL_KR4718
PADEL_KR4719	Oc1ccc(cc1)[N+](=O)[O-]	PADEL_KR4719
PADEL_KR4720	Oc1ccc(cc1)C(=O)c2ccccc2	PADEL_KR4720
PADEL_KR4721	Oc1ccc(cc1)C(=O)NN=Cc2ccccc2	PADEL_KR4721
PADEL_KR4722	Oc1ccc(cc1)C(c2ccccc2)(c3ccccc3)c4ccc(O)cc4	PADEL_KR4722
PADEL_KR4723	Oc1ccc(cc1)C(O)(c2ccccc2)c3ccccc3	PADEL_KR4723
PADEL_KR4724	Oc1ccc(cc1)S(=O)(=O)c2ccc(O)cc2	PADEL_KR4724
PADEL_KR4725	Oc1ccc(cc1)S(=O)=O	PADEL_KR4725
PADEL_KR4726	Oc1ccc(cc1C=N)[N+](=O)[O-]	PADEL_KR4726
PADEL_KR4727	Oc1ccc(cc1C=NNC=O)[N+](=O)[O-]	PADEL_KR4727
PADEL_KR4728	Oc1ccc(CCC=O)cc1	PADEL_KR4728
PADEL_KR4729	Oc1ccc(Cl)cc1	PADEL_KR4729
PADEL_KR4730	Oc1ccc(Cl)cc1C=N	PADEL_KR4730
PADEL_KR4731	Oc1ccc(Cl)cc1C=NNC=O	PADEL_KR4731
PADEL_KR4732	Oc1ccc(Cl)cc1C=O	PADEL_KR4732
PADEL_KR4733	Oc1ccc(Cl)cc1Cl	PADEL_KR4733
PADEL_KR4734	Oc1ccc(F)cc1	PADEL_KR4734
PADEL_KR4735	Oc1ccc(NC=O)cc1	PADEL_KR4735
PADEL_KR4736	Oc1ccc(O)cc1	PADEL_KR4736
PADEL_KR4737	Oc1ccc2[nH]c3CCCCc3c2c1	PADEL_KR4737
PADEL_KR4738	Oc1ccc2c(=O)ccoc2c1	PADEL_KR4738
PADEL_KR4739	Oc1ccc2C(=O)OC(=O)c2c1	PADEL_KR4739
PADEL_KR4740	Oc1ccc2ccccc2c1	PADEL_KR4740
PADEL_KR4741	Oc1ccc2ccccc2c1C=N	PADEL_KR4741
PADEL_KR4742	Oc1ccc2ccccc2c1C=Nc3ccccc3	PADEL_KR4742
PADEL_KR4743	Oc1ccc2ccccc2c1C=NNC=O	PADEL_KR4743
PADEL_KR4744	Oc1ccc2ccccc2c1Cc3c(O)ccc4ccccc34	PADEL_KR4744
PADEL_KR4745	Oc1ccc2ccccc2c1Cc3ccccc3	PADEL_KR4745
PADEL_KR4746	Oc1cccc(C=N)c1	PADEL_KR4746
PADEL_KR4747	Oc1cccc(C=O)c1	PADEL_KR4747
PADEL_KR4748	Oc1cccc(c1)[N+](=O)[O-]	PADEL_KR4748
PADEL_KR4749	Oc1cccc(CC=O)c1	PADEL_KR4749
PADEL_KR4750	Oc1cccc(NC(=S)NCC(Cl)(Cl)Cl)c1	PADEL_KR4750
PADEL_KR4751	Oc1cccc(NC=O)c1	PADEL_KR4751
PADEL_KR4752	Oc1cccc(O)c1	PADEL_KR4752
PADEL_KR4753	Oc1cccc(O)c1O	PADEL_KR4753
PADEL_KR4754	OC1CCCC1	PADEL_KR4754
PADEL_KR4755	Oc1cccc2ccccc12	PADEL_KR4755
PADEL_KR4756	Oc1cccc2cccnc12	PADEL_KR4756
PADEL_KR4757	OC1CCCCC1	PADEL_KR4757
PADEL_KR4758	Oc1ccccc1[N+](=O)[O-]	PADEL_KR4758
PADEL_KR4759	Oc1ccccc1Br	PADEL_KR4759
PADEL_KR4760	Oc1ccccc1C=N	PADEL_KR4760
PADEL_KR4761	Oc1ccccc1C=Nc2ccccc2	PADEL_KR4761
PADEL_KR4762	Oc1ccccc1C=NNC=O	PADEL_KR4762
PADEL_KR4763	Oc1ccccc1C=O	PADEL_KR4763
PADEL_KR4764	Oc1ccccc1Cc2ccccc2	PADEL_KR4764
PADEL_KR4765	Oc1ccccc1Cl	PADEL_KR4765
PADEL_KR4766	Oc1ccccc1F	PADEL_KR4766
PADEL_KR4767	Oc1ccccc1I	PADEL_KR4767
PADEL_KR4768	Oc1ccccc1NC(=S)NCC(Cl)(Cl)Cl	PADEL_KR4768
PADEL_KR4769	Oc1ccccc1NC=O	PADEL_KR4769
PADEL_KR4770	Oc1ccccc1O	PADEL_KR4770
PADEL_KR4771	Oc1ccccc1S(=O)(=O)O	PADEL_KR4771
PADEL_KR4772	Oc1cccnc1	PADEL_KR4772
PADEL_KR4773	OC1CCS(=O)(=O)C1	PADEL_KR4773
PADEL_KR4774	OCC#C	PADEL_KR4774
PADEL_KR4775	OCC(=O)c1ccc(Br)cc1	PADEL_KR4775
PADEL_KR4776	OCC(=O)c1ccc(cc1)[N+](=O)[O-]	PADEL_KR4776
PADEL_KR4777	OCC(=O)c1ccc(Cl)cc1	PADEL_KR4777
PADEL_KR4778	OCC(=O)c1ccccc1	PADEL_KR4778
PADEL_KR4779	OCC(=O)NC(=O)O	PADEL_KR4779
PADEL_KR4780	OCC(=O)NN=C	PADEL_KR4780
PADEL_KR4781	OCC(=O)NN=C1C(=O)Nc2ccc(cc12)[N+](=O)[O-]	PADEL_KR4781
PADEL_KR4782	OCC(=O)NN=C1C(=O)Nc2ccccc12	PADEL_KR4782
PADEL_KR4783	OCC(=O)NN=CC=C	PADEL_KR4783
PADEL_KR4784	OCC(=O)NN=CC=Cc1cccc(c1)[N+](=O)[O-]	PADEL_KR4784
PADEL_KR4785	OCC(=O)NN=Cc1c(Cl)cccc1Cl	PADEL_KR4785
PADEL_KR4786	OCC(=O)NN=Cc1c(O)ccc2ccccc12	PADEL_KR4786
PADEL_KR4787	OCC(=O)NN=Cc1cc(ccc1O)[N+](=O)[O-]	PADEL_KR4787
PADEL_KR4788	OCC(=O)NN=Cc1cc(I)ccc1O	PADEL_KR4788
PADEL_KR4789	OCC(=O)NN=Cc1cc(N=Nc2ccccc2)ccc1O	PADEL_KR4789
PADEL_KR4790	OCC(=O)NN=Cc1cc2ccccc2nc1Cl	PADEL_KR4790
PADEL_KR4791	OCC(=O)NN=Cc1cc2OCOc2cc1[N+](=O)[O-]	PADEL_KR4791
PADEL_KR4792	OCC(=O)NN=Cc1ccc(O)c(c1)[N+](=O)[O-]	PADEL_KR4792
PADEL_KR4793	OCC(=O)NN=Cc1ccc(O)cc1	PADEL_KR4793
PADEL_KR4794	OCC(=O)NN=Cc1ccc(s1)[N+](=O)[O-]	PADEL_KR4794
PADEL_KR4795	OCC(=O)NN=Cc1cccc(c1)[N+](=O)[O-]	PADEL_KR4795
PADEL_KR4796	OCC(=O)NN=Cc1cccc(O)c1	PADEL_KR4796
PADEL_KR4797	OCC(=O)NN=Cc1cccc2ccccc12	PADEL_KR4797
PADEL_KR4798	OCC(=O)NN=Cc1ccccc1	PADEL_KR4798
PADEL_KR4799	OCC(=O)NN=Cc1ccccc1[N+](=O)[O-]	PADEL_KR4799
PADEL_KR4800	OCC(=O)NN=Cc1ccccc1Cl	PADEL_KR4800
PADEL_KR4801	OCC(=O)NN=Cc1ccccc1O	PADEL_KR4801
PADEL_KR4802	OCC(=O)NNC=O	PADEL_KR4802
PADEL_KR4803	OCC(=O)O	PADEL_KR4803
PADEL_KR4804	OCC(=O)OCC=O	PADEL_KR4804
PADEL_KR4805	OCC(c1ccccc1)c2ccccc2	PADEL_KR4805
PADEL_KR4806	OCC(Cl)(Cl)Cl	PADEL_KR4806
PADEL_KR4807	OCC(CO)(CO)NC=O	PADEL_KR4807
PADEL_KR4808	OCC(F)(F)F	PADEL_KR4808
PADEL_KR4809	OCC(O)CNS(=O)(=O)O	PADEL_KR4809
PADEL_KR4810	OCC=C	PADEL_KR4810
PADEL_KR4811	OCC=O	PADEL_KR4811
PADEL_KR4812	OCc1cccc(Br)c1	PADEL_KR4812
PADEL_KR4813	OCc1ccccc1	PADEL_KR4813
PADEL_KR4814	OCc1ccccc1C(=O)Cc2ccccc2	PADEL_KR4814
PADEL_KR4815	OCc1ccccc1C=O	PADEL_KR4815
PADEL_KR4816	OCc1nc2ccccc2[nH]1	PADEL_KR4816
PADEL_KR4817	OCC1OCC(O)C(O)C1O	PADEL_KR4817
PADEL_KR4818	OCC1OCC(O)C1O	PADEL_KR4818
PADEL_KR4819	OCCC(O)c1ccc(cc1)[N+](=O)[O-]	PADEL_KR4819
PADEL_KR4820	OCCc1ccccc1	PADEL_KR4820
PADEL_KR4821	OCCCC=O	PADEL_KR4821
PADEL_KR4822	OCCCl	PADEL_KR4822
PADEL_KR4823	OCCCNC=O	PADEL_KR4823
PADEL_KR4824	OCCF	PADEL_KR4824
PADEL_KR4825	OCCN(CCO)S(=O)=O	PADEL_KR4825
PADEL_KR4826	OCCNC=O	PADEL_KR4826
PADEL_KR4827	OCCNCCO	PADEL_KR4827
PADEL_KR4828	OCCNS(=O)=O	PADEL_KR4828
PADEL_KR4829	OCCO	PADEL_KR4829
PADEL_KR4830	OCCOC=O	PADEL_KR4830
PADEL_KR4831	OCCS	PADEL_KR4831
PADEL_KR4832	OCCS(=O)=O	PADEL_KR4832
PADEL_KR4833	ON(=O)c1ccccc1	PADEL_KR4833
PADEL_KR4834	ON=C	PADEL_KR4834
PADEL_KR4835	ONC=O	PADEL_KR4835
PADEL_KR4836	OP(=O)(O)O	PADEL_KR4836
PADEL_KR4837	OS(=O)(=O)c1ccc(NN=C(C=O)C=O)cc1	PADEL_KR4837
PADEL_KR4838	OS(=O)(=O)c1ccc(NN=Cc2ccccc2)cc1	PADEL_KR4838
PADEL_KR4839	OS(=O)(=O)c1ccccc1	PADEL_KR4839
PADEL_KR4840	OS(=O)(=O)CCCS	PADEL_KR4840
PADEL_KR4841	OS(=O)(=O)CCS	PADEL_KR4841
PADEL_KR4842	OS(=O)=O	PADEL_KR4842
PADEL_KR4843	S	PADEL_KR4843
PADEL_KR4844	S=C(Nc1ccccc1)Nc2ccccc2	PADEL_KR4844
PADEL_KR4845	S=c1[nH]c2ccccc2[nH]1	PADEL_KR4845
PADEL_KR4846	S=c1[nH]c2ccccc2o1	PADEL_KR4846
PADEL_KR4847	S=c1[nH]c2ccccc2s1	PADEL_KR4847
PADEL_KR4848	S=C1NC=CC(N1)c2ccccc2	PADEL_KR4848
PADEL_KR4849	SC(=N)NN=C	PADEL_KR4849
PADEL_KR4850	SC(=O)c1ccccc1	PADEL_KR4850
PADEL_KR4851	SC(NC=O)C(Cl)(Cl)Cl	PADEL_KR4851
PADEL_KR4852	SC=O	PADEL_KR4852
PADEL_KR4853	S(c1ccccc1)	PADEL_KR4853
PADEL_KR4854	S(c1nc2ccccc2s1)	PADEL_KR4854
PADEL_KR4855	SCC(=O)NN=C	PADEL_KR4855
PADEL_KR4856	SCC=O	PADEL_KR4856
PADEL_KR4857	SCc1ccccc1	PADEL_KR4857
PADEL_KR4858	SCCC=O	PADEL_KR4858
PADEL_KR4859	SCCS	PADEL_KR4859
PADEL_KR4860	SCCS(=O)=O	PADEL_KR4860
PUBCHEM_0	[#1]	PUBCHEM_0
PUBCHEM_1	[#1]	PUBCHEM_1
PUBCHEM_2	[#1]	PUBCHEM_2
PUBCHEM_3	[#1]	PUBCHEM_3
PUBCHEM_4	[#3]	PUBCHEM_4
PUBCHEM_5	[#3]	PUBCHEM_5
PUBCHEM_6	[#5]	PUBCHEM_6
PUBCHEM_7	[#5]	PUBCHEM_7
PUBCHEM_8	[#5]	PUBCHEM_8
PUBCHEM_9	[#6]	PUBCHEM_9
PUBCHEM_10	[#6]	PUBCHEM_10
PUBCHEM_11	[#6]	PUBCHEM_11
PUBCHEM_12	[#6]	PUBCHEM_12
PUBCHEM_13	[#6]	PUBCHEM_13
PUBCHEM_14	[#7]	PUBCHEM_14
PUBCHEM_15	[#7]	PUBCHEM_15
PUBCHEM_16	[#7]	PUBCHEM_16
PUBCHEM_17	[#7]	PUBCHEM_17
PUBCHEM_18	[#8]	PUBCHEM_18
PUBCHEM_19	[#8]	PUBCHEM_19
PUBCHEM_20	[#8]	PUBCHEM_20
PUBCHEM_21	[#8]	PUBCHEM_21
PUBCHEM_22	[#8]	PUBCHEM_22
PUBCHEM_23	[#9]	PUBCHEM_23
PUBCHEM_24	[#9]	PUBCHEM_24
PUBCHEM_25	[#9]	PUBCHEM_25
PUBCHEM_26	[Na]	PUBCHEM_26
PUBCHEM_27	[Na]	PUBCHEM_27
PUBCHEM_28	[#14]	PUBCHEM_28
PUBCHEM_29	[#14]	PUBCHEM_29
PUBCHEM_30	[#15]	PUBCHEM_30
PUBCHEM_31	[#15]	PUBCHEM_31
PUBCHEM_32	[#15]	PUBCHEM_32
PUBCHEM_33	[#16]	PUBCHEM_33
PUBCHEM_34	[#16]	PUBCHEM_34
PUBCHEM_35	[#16]	PUBCHEM_35
PUBCHEM_36	[#16]	PUBCHEM_36
PUBCHEM_37	[#17]	PUBCHEM_37
PUBCHEM_38	[#17]	PUBCHEM_38
PUBCHEM_39	[#17]	PUBCHEM_39
PUBCHEM_40	[#17]	PUBCHEM_40
PUBCHEM_41	[K]	PUBCHEM_41
PUBCHEM_42	[K]	PUBCHEM_42
PUBCHEM_43	[#35]	PUBCHEM_43
PUBCHEM_44	[#35]	PUBCHEM_44
PUBCHEM_45	[#35]	PUBCHEM_45
PUBCHEM_46	[#53]	PUBCHEM_46
PUBCHEM_47	[#53]	PUBCHEM_47
PUBCHEM_48	[#53]	PUBCHEM_48
PUBCHEM_49	[Be]	PUBCHEM_49
PUBCHEM_50	[Mg]	PUBCHEM_50
PUBCHEM_51	[#13]	PUBCHEM_51
PUBCHEM_52	[Ca]	PUBCHEM_52
PUBCHEM_53	[Sc]	PUBCHEM_53
PUBCHEM_54	[Ti]	PUBCHEM_54
PUBCHEM_55	[V]	PUBCHEM_55
PUBCHEM_56	[Cr]	PUBCHEM_56
PUBCHEM_57	[Mn]	PUBCHEM_57
PUBCHEM_58	[Fe]	PUBCHEM_58
PUBCHEM_59	[Co]	PUBCHEM_59
PUBCHEM_60	[Ni]	PUBCHEM_60
PUBCHEM_61	[Cu]	PUBCHEM_61
PUBCHEM_62	[Zn]	PUBCHEM_62
PUBCHEM_63	[#31]	PUBCHEM_63
PUBCHEM_64	[#32]	PUBCHEM_64
PUBCHEM_65	[#33]	PUBCHEM_65
PUBCHEM_66	[#34]	PUBCHEM_66
PUBCHEM_67	[Kr]	PUBCHEM_67
PUBCHEM_68	[Rb]	PUBCHEM_68
PUBCHEM_69	[Sr]	PUBCHEM_69
PUBCHEM_70	[Y]	PUBCHEM_70
PUBCHEM_71	[Zr]	PUBCHEM_71
PUBCHEM_72	[Nb]	PUBCHEM_72
PUBCHEM_73	[Mo]	PUBCHEM_73
PUBCHEM_74	[Ru]	PUBCHEM_74
PUBCHEM_75	[Rh]	PUBCHEM_75
PUBCHEM_76	[Pd]	PUBCHEM_76
PUBCHEM_77	[Ag]	PUBCHEM_77
PUBCHEM_78	[Cd]	PUBCHEM_78
PUBCHEM_79	[#49]	PUBCHEM_79
PUBCHEM_80	[#50]	PUBCHEM_80
PUBCHEM_81	[#51]	PUBCHEM_81
PUBCHEM_82	[#52]	PUBCHEM_82
PUBCHEM_83	[Xe]	PUBCHEM_83
PUBCHEM_84	[Cs]	PUBCHEM_84
PUBCHEM_85	[Ba]	PUBCHEM_85
PUBCHEM_86	[Lu]	PUBCHEM_86
PUBCHEM_87	[Hf]	PUBCHEM_87
PUBCHEM_88	[Ta]	PUBCHEM_88
PUBCHEM_89	[W]	PUBCHEM_89
PUBCHEM_90	[Re]	PUBCHEM_90
PUBCHEM_91	[Os]	PUBCHEM_91
PUBCHEM_92	[Ir]	PUBCHEM_92
PUBCHEM_93	[Pt]	PUBCHEM_93
PUBCHEM_94	[Au]	PUBCHEM_94
PUBCHEM_95	[Hg]	PUBCHEM_95
PUBCHEM_96	[#81]	PUBCHEM_96
PUBCHEM_97	[#82]	PUBCHEM_97
PUBCHEM_98	[#83]	PUBCHEM_98
PUBCHEM_99	[La]	PUBCHEM_99
PUBCHEM_100	[Ce]	PUBCHEM_100
PUBCHEM_101	[Pr]	PUBCHEM_101
PUBCHEM_102	[Nd]	PUBCHEM_102
PUBCHEM_103	[Pm]	PUBCHEM_103
PUBCHEM_104	[Sm]	PUBCHEM_104
PUBCHEM_105	[Eu]	PUBCHEM_105
PUBCHEM_106	[Gd]	PUBCHEM_106
PUBCHEM_107	[Tb]	PUBCHEM_107
PUBCHEM_108	[Dy]	PUBCHEM_108
PUBCHEM_109	[Ho]	PUBCHEM_109
PUBCHEM_110	[Er]	PUBCHEM_110
PUBCHEM_111	[Tm]	PUBCHEM_111
PUBCHEM_112	[Yb]	PUBCHEM_112
PUBCHEM_113	[Tc]	PUBCHEM_113
PUBCHEM_114	[U]	PUBCHEM_114
PUBCHEM_115	[*]1@[*]@[*]1	PUBCHEM_115
PUBCHEM_116	[#6]1[#6][#6]1	PUBCHEM_116
PUBCHEM_117	[#7]1[*][*]1	PUBCHEM_117
PUBCHEM_118	[!#6]1[*][*]1	PUBCHEM_118
PUBCHEM_119	"[$([#6]1=,#[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]1)]"	PUBCHEM_119
PUBCHEM_120	"[$([#7]1=,#[*]!:[*]1),$([#7]1!:[*]=,#[*]1)]"	PUBCHEM_120
PUBCHEM_121	"[$([!#6]1=,#[*]!:[*]1),$([!#6]1!:[*]=,#[*]1)]"	PUBCHEM_121
PUBCHEM_122	[*]1@[*]@[*]1	PUBCHEM_122
PUBCHEM_123	[#6]1[#6][#6]1	PUBCHEM_123
PUBCHEM_124	[#7]1[*][*]1	PUBCHEM_124
PUBCHEM_125	[!#6]1[*][*]1	PUBCHEM_125
PUBCHEM_126	"[$([#6]1=,#[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]1)]"	PUBCHEM_126
PUBCHEM_127	"[$([#7]1=,#[*]!:[*]1),$([#7]1!:[*]=,#[*]1)]"	PUBCHEM_127
PUBCHEM_128	"[$([!#6]1=,#[*]!:[*]1),$([!#6]1!:[*]=,#[*]1)]"	PUBCHEM_128
PUBCHEM_129	[*]1@[*]@[*]@[*]1	PUBCHEM_129
PUBCHEM_130	[#6]1[#6][#6][#6]1	PUBCHEM_130
PUBCHEM_131	[#7]1[*][*][*]1	PUBCHEM_131
PUBCHEM_132	[!#6]1[*][*][*]1	PUBCHEM_132
PUBCHEM_133	"[$([#6]1=,#[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]!:[#6]1)]"	PUBCHEM_133
PUBCHEM_134	"[$([#7]1=,#[*]!:[*]!:[*]1),$([#7]1!:[*]=,#[*]!:[*]1)]"	PUBCHEM_134
PUBCHEM_135	"[$([!#6]1=,#[*]!:[*]!:[*]1),$([!#6]1!:[*]=,#[*]!:[*]1)]"	PUBCHEM_135
PUBCHEM_136	[*]1@[*]@[*]@[*]1	PUBCHEM_136
PUBCHEM_137	[#6]1[#6][#6][#6]1	PUBCHEM_137
PUBCHEM_138	[#7]1[*][*][*]1	PUBCHEM_138
PUBCHEM_139	[!#6]1[*][*][*]1	PUBCHEM_139
PUBCHEM_140	"[$([#6]1=,#[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]!:[#6]1)]"	PUBCHEM_140
PUBCHEM_141	"[$([#7]1=,#[*]!:[*]!:[*]1),$([#7]1!:[*]=,#[*]!:[*]1)]"	PUBCHEM_141
PUBCHEM_142	"[$([!#6]1=,#[*]!:[*]!:[*]1),$([!#6]1!:[*]=,#[*]!:[*]1)]"	PUBCHEM_142
PUBCHEM_143	[*]1@[*]@[*]@[*]@[*]1	PUBCHEM_143
PUBCHEM_144	[#6]1[#6][#6][#6][#6]1	PUBCHEM_144
PUBCHEM_145	[#7]1[*][*][*][*]1	PUBCHEM_145
PUBCHEM_146	[!#6]1[*][*][*][*]1	PUBCHEM_146
PUBCHEM_147	"[$([#6]1=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]=,#[#6]!:[#6]1)]"	PUBCHEM_147
PUBCHEM_148	"[$([#7]1=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]=,#[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]=,#[#6]!:[#6]1)]"	PUBCHEM_148
PUBCHEM_149	"[$([!#6]1=,#[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]=,#[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]=,#[#6]!:[#6]1)]"	PUBCHEM_149
PUBCHEM_150	[*]1@[*]@[*]@[*]@[*]1	PUBCHEM_150
PUBCHEM_151	[#6]1[#6][#6][#6][#6]1	PUBCHEM_151
PUBCHEM_152	[#7]1[*][*][*][*]1	PUBCHEM_152
PUBCHEM_153	[!#6]1[*][*][*][*]1	PUBCHEM_153
PUBCHEM_154	"[$([#6]1=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]=,#[#6]!:[#6]1)]"	PUBCHEM_154
PUBCHEM_155	"[$([#7]1=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]=,#[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]=,#[#6]!:[#6]1)]"	PUBCHEM_155
PUBCHEM_156	"[$([!#6]1=,#[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]=,#[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]=,#[#6]!:[#6]1)]"	PUBCHEM_156
PUBCHEM_157	[*]1@[*]@[*]@[*]@[*]1	PUBCHEM_157
PUBCHEM_158	[#6]1[#6][#6][#6][#6]1	PUBCHEM_158
PUBCHEM_159	[#7]1[*][*][*][*]1	PUBCHEM_159
PUBCHEM_160	[!#6]1[*][*][*][*]1	PUBCHEM_160
PUBCHEM_161	"[$([#6]1=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]=,#[#6]!:[#6]1)]"	PUBCHEM_161
PUBCHEM_162	"[$([#7]1=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]=,#[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]=,#[#6]!:[#6]1)]"	PUBCHEM_162
PUBCHEM_163	"[$([!#6]1=,#[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]=,#[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]=,#[#6]!:[#6]1)]"	PUBCHEM_163
PUBCHEM_164	[*]1@[*]@[*]@[*]@[*]1	PUBCHEM_164
PUBCHEM_165	[#6]1[#6][#6][#6][#6]1	PUBCHEM_165
PUBCHEM_166	[#7]1[*][*][*][*]1	PUBCHEM_166
PUBCHEM_167	[!#6]1[*][*][*][*]1	PUBCHEM_167
PUBCHEM_168	"[$([#6]1=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]=,#[#6]!:[#6]1)]"	PUBCHEM_168
PUBCHEM_169	"[$([#7]1=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]=,#[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]=,#[#6]!:[#6]1)]"	PUBCHEM_169
PUBCHEM_170	"[$([!#6]1=,#[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]=,#[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]=,#[#6]!:[#6]1)]"	PUBCHEM_170
PUBCHEM_171	[*]1@[*]@[*]@[*]@[*]1	PUBCHEM_171
PUBCHEM_172	[#6]1[#6][#6][#6][#6]1	PUBCHEM_172
PUBCHEM_173	[#7]1[*][*][*][*]1	PUBCHEM_173
PUBCHEM_174	[!#6]1[*][*][*][*]1	PUBCHEM_174
PUBCHEM_175	"[$([#6]1=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]=,#[#6]!:[#6]1)]"	PUBCHEM_175
PUBCHEM_176	"[$([#7]1=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]=,#[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]=,#[#6]!:[#6]1)]"	PUBCHEM_176
PUBCHEM_177	"[$([!#6]1=,#[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]=,#[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]=,#[#6]!:[#6]1)]"	PUBCHEM_177
PUBCHEM_178	[*]1@[*]@[*]@[*]@[*]@[*]1	PUBCHEM_178
PUBCHEM_179	[#6]1[#6][#6][#6][#6][#6]1	PUBCHEM_179
PUBCHEM_180	[#7]1[*][*][*][*][*]1	PUBCHEM_180
PUBCHEM_181	[!#6]1[*][*][*][*][*]1	PUBCHEM_181
PUBCHEM_182	"[$([#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_182
PUBCHEM_183	"[$([#7]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_183
PUBCHEM_184	"[$([!#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_184
PUBCHEM_185	[*]1@[*]@[*]@[*]@[*]@[*]1	PUBCHEM_185
PUBCHEM_186	[#6]1[#6][#6][#6][#6][#6]1	PUBCHEM_186
PUBCHEM_187	[#7]1[*][*][*][*][*]1	PUBCHEM_187
PUBCHEM_188	[!#6]1[*][*][*][*][*]1	PUBCHEM_188
PUBCHEM_189	"[$([#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_189
PUBCHEM_190	"[$([#7]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_190
PUBCHEM_191	"[$([!#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_191
PUBCHEM_192	[*]1@[*]@[*]@[*]@[*]@[*]1	PUBCHEM_192
PUBCHEM_193	[#6]1[#6][#6][#6][#6][#6]1	PUBCHEM_193
PUBCHEM_194	[#7]1[*][*][*][*][*]1	PUBCHEM_194
PUBCHEM_195	[!#6]1[*][*][*][*][*]1	PUBCHEM_195
PUBCHEM_196	"[$([#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_196
PUBCHEM_197	"[$([#7]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_197
PUBCHEM_198	"[$([!#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_198
PUBCHEM_199	[*]1@[*]@[*]@[*]@[*]@[*]1	PUBCHEM_199
PUBCHEM_200	[#6]1[#6][#6][#6][#6][#6]1	PUBCHEM_200
PUBCHEM_201	[#7]1[*][*][*][*][*]1	PUBCHEM_201
PUBCHEM_202	[!#6]1[*][*][*][*][*]1	PUBCHEM_202
PUBCHEM_203	"[$([#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_203
PUBCHEM_204	"[$([#7]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_204
PUBCHEM_205	"[$([!#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_205
PUBCHEM_206	[*]1@[*]@[*]@[*]@[*]@[*]1	PUBCHEM_206
PUBCHEM_207	[#6]1[#6][#6][#6][#6][#6]1	PUBCHEM_207
PUBCHEM_208	[#7]1[*][*][*][*][*]1	PUBCHEM_208
PUBCHEM_209	[!#6]1[*][*][*][*][*]1	PUBCHEM_209
PUBCHEM_210	"[$([#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_210
PUBCHEM_211	"[$([#7]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_211
PUBCHEM_212	"[$([!#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_212
PUBCHEM_213	[*]1@[*]@[*]@[*]@[*]@[*]@[*]1	PUBCHEM_213
PUBCHEM_214	[#6]1[#6][#6][#6][#6][#6][#6]1	PUBCHEM_214
PUBCHEM_215	[#7]1[*][*][*][*][*][*]1	PUBCHEM_215
PUBCHEM_216	[!#6]1[*][*][*][*][*][*]1	PUBCHEM_216
PUBCHEM_217	"[$([#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_217
PUBCHEM_218	"[$([#7]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_218
PUBCHEM_219	"[$([!#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_219
PUBCHEM_220	[*]1@[*]@[*]@[*]@[*]@[*]@[*]1	PUBCHEM_220
PUBCHEM_221	[#6]1[#6][#6][#6][#6][#6][#6]1	PUBCHEM_221
PUBCHEM_222	[#7]1[*][*][*][*][*][*]1	PUBCHEM_222
PUBCHEM_223	[!#6]1[*][*][*][*][*][*]1	PUBCHEM_223
PUBCHEM_224	"[$([#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_224
PUBCHEM_225	"[$([#7]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_225
PUBCHEM_226	"[$([!#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]1)]"	PUBCHEM_226
PUBCHEM_227	[*]1@[*]@[*]@[*]@[*]@[*]@[*]@[*]1	PUBCHEM_227
PUBCHEM_228	[#6]1[#6][#6][#6][#6][#6][#6][#6]1	PUBCHEM_228
PUBCHEM_229	[#7]1[*][*][*][*][*][*][*]1	PUBCHEM_229
PUBCHEM_230	[!#6]1[*][*][*][*][*][*][*]1	PUBCHEM_230
PUBCHEM_231	"[$([#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1)]"	PUBCHEM_231
PUBCHEM_232	"[$([#7]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1)]"	PUBCHEM_232
PUBCHEM_233	"[$([!#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1)]"	PUBCHEM_233
PUBCHEM_234	[*]1@[*]@[*]@[*]@[*]@[*]@[*]@[*]1	PUBCHEM_234
PUBCHEM_235	[#6]1[#6][#6][#6][#6][#6][#6][#6]1	PUBCHEM_235
PUBCHEM_236	[#7]1[*][*][*][*][*][*][*]1	PUBCHEM_236
PUBCHEM_237	[!#6]1[*][*][*][*][*][*][*]1	PUBCHEM_237
PUBCHEM_238	"[$([#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1)]"	PUBCHEM_238
PUBCHEM_239	"[$([#7]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1)]"	PUBCHEM_239
PUBCHEM_240	"[$([!#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1)]"	PUBCHEM_240
PUBCHEM_241	[*]1@[*]@[*]@[*]@[*]@[*]@[*]@[*]@[*]1	PUBCHEM_241
PUBCHEM_242	[#6]1[#6][#6][#6][#6][#6][#6][#6][#6]1	PUBCHEM_242
PUBCHEM_243	[#7]1[*][*][*][*][*][*][*][*]1	PUBCHEM_243
PUBCHEM_244	[!#6]1[*][*][*][*][*][*][*][*]1	PUBCHEM_244
PUBCHEM_245	"[$([#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1)]"	PUBCHEM_245
PUBCHEM_246	"[$([#7]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1)]"	PUBCHEM_246
PUBCHEM_247	"[$([!#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]1)]"	PUBCHEM_247
PUBCHEM_248	[*]1@[*]@[*]@[*]@[*]@[*]@[*]@[*]@[*]@[*]1	PUBCHEM_248
PUBCHEM_249	[#6]1[#6][#6][#6][#6][#6][#6][#6][#6][#6]1	PUBCHEM_249
PUBCHEM_250	[#7]1[*][*][*][*][*][*][*][*][*]1	PUBCHEM_250
PUBCHEM_251	[!#6]1[*][*][*][*][*][*][*][*][*]1	PUBCHEM_251
PUBCHEM_252	"[$([#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#6]1!:[#6]!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1)]"	PUBCHEM_252
PUBCHEM_253	"[$([#7]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([#7]1!:[#6]!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1)]"	PUBCHEM_253
PUBCHEM_254	"[$([!#6]1=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]!:[#6]1),$([!#6]1!:[#6]!:[#6]!:[#6]!:[#6]=,#[#6]!:[#6]!:[#6]!:[#6]!:[#6]1)]"	PUBCHEM_254
PUBCHEM_255	"(a1:a:a1),(a1:a:a:a1),(a1:a:a:a:a1),(a1:a:a:a:a:a1),(a1:a:a:a:a:a:a1),(a1:a:a:a:a:a:a:a1),(a1:a:a:a:a:a:a:a:a:a1)"	PUBCHEM_255
PUBCHEM_256	"[$([!#6;a]1:a:a1),$([!#6;a]1:a:a:a1),$([!#6;a]1:a:a:a:a1),$([!#6;a]1:a:a:a:a:a1),$([!#6;a]1:a:a:a:a:a:a1),$([!#6;a]1:a:a:a:a:a:a:a1),$([!#6,a]1:a:a:a:a:a:a:a:a:a1)]"	PUBCHEM_256
PUBCHEM_257	"[$(a1:a:a1),$(a1:a:a:a1),$(a1:a:a:a:a1),$(a1:a:a:a:a:a1),$(a1:a:a:a:a:a:a1),$(a1:a:a:a:a:a:a:a1),$(a1:a:a:a:a:a:a:a:a:a1)]"	PUBCHEM_257
PUBCHEM_258	"[$([!#6;a]1:a:a1),$([!#6;a]1:a:a:a1),$([!#6;a]1:a:a:a:a1),$([!#6;a]1:a:a:a:a:a1),$([!#6;a]1:a:a:a:a:a:a1),$([!#6;a]1:a:a:a:a:a:a:a1),$([!#6,a]1:a:a:a:a:a:a:a:a:a1)]"	PUBCHEM_258
PUBCHEM_259	"[$(a1:a:a1),$(a1:a:a:a1),$(a1:a:a:a:a1),$(a1:a:a:a:a:a1),$(a1:a:a:a:a:a:a1),$(a1:a:a:a:a:a:a:a1),$(a1:a:a:a:a:a:a:a:a:a1)]"	PUBCHEM_259
PUBCHEM_260	"[$([!#6;a]1:a:a1),$([!#6;a]1:a:a:a1),$([!#6;a]1:a:a:a:a1),$([!#6;a]1:a:a:a:a:a1),$([!#6;a]1:a:a:a:a:a:a1),$([!#6;a]1:a:a:a:a:a:a:a1),$([!#6,a]1:a:a:a:a:a:a:a:a:a1)]"	PUBCHEM_260
PUBCHEM_261	"[$(a1:a:a1),$(a1:a:a:a1),$(a1:a:a:a:a1),$(a1:a:a:a:a:a1),$(a1:a:a:a:a:a:a1),$(a1:a:a:a:a:a:a:a1),$(a1:a:a:a:a:a:a:a:a:a1)]"	PUBCHEM_261
PUBCHEM_262	"[$([!#6;a]1:a:a1),$([!#6;a]1:a:a:a1),$([!#6;a]1:a:a:a:a1),$([!#6;a]1:a:a:a:a:a1),$([!#6;a]1:a:a:a:a:a:a1),$([!#6;a]1:a:a:a:a:a:a:a1),$([!#6,a]1:a:a:a:a:a:a:a:a:a1)]"	PUBCHEM_262
PUBCHEM_263	[#3]~[#1]	PUBCHEM_263
PUBCHEM_264	[#3]~[#3]	PUBCHEM_264
PUBCHEM_265	[#3]~[#5]	PUBCHEM_265
PUBCHEM_266	[#3]~[#6]	PUBCHEM_266
PUBCHEM_267	[#3]~[#8]	PUBCHEM_267
PUBCHEM_268	[#3]~[#9]	PUBCHEM_268
PUBCHEM_269	[#3]~[#15]	PUBCHEM_269
PUBCHEM_270	[#3]~[#16]	PUBCHEM_270
PUBCHEM_271	[#3]~[#17]	PUBCHEM_271
PUBCHEM_272	[#5]~[#1]	PUBCHEM_272
PUBCHEM_273	[#5]~[#5]	PUBCHEM_273
PUBCHEM_274	[#5]~[#6]	PUBCHEM_274
PUBCHEM_275	[#5]~[#7]	PUBCHEM_275
PUBCHEM_276	[#5]~[#8]	PUBCHEM_276
PUBCHEM_277	[#5]~[#9]	PUBCHEM_277
PUBCHEM_278	[#5]~[#14]	PUBCHEM_278
PUBCHEM_279	[#5]~[#15]	PUBCHEM_279
PUBCHEM_280	[#5]~[#16]	PUBCHEM_280
PUBCHEM_281	[#5]~[#17]	PUBCHEM_281
PUBCHEM_282	[#5]~[#35]	PUBCHEM_282
PUBCHEM_283	[#6]~[#1]	PUBCHEM_283
PUBCHEM_284	[#6]~[#6]	PUBCHEM_284
PUBCHEM_285	[#6]~[#7]	PUBCHEM_285
PUBCHEM_286	[#6]~[#8]	PUBCHEM_286
PUBCHEM_287	[#6]~[#9]	PUBCHEM_287
PUBCHEM_288	[#6]~[#11]	PUBCHEM_288
PUBCHEM_289	[#6]~[#12]	PUBCHEM_289
PUBCHEM_290	[#6]~[#13]	PUBCHEM_290
PUBCHEM_291	[#6]~[#14]	PUBCHEM_291
PUBCHEM_292	[#6]~[#15]	PUBCHEM_292
PUBCHEM_293	[#6]~[#16]	PUBCHEM_293
PUBCHEM_294	[#6]~[#17]	PUBCHEM_294
PUBCHEM_295	[#6]~[#33]	PUBCHEM_295
PUBCHEM_296	[#6]~[#34]	PUBCHEM_296
PUBCHEM_297	[#6]~[#35]	PUBCHEM_297
PUBCHEM_298	[#6]~[#53]	PUBCHEM_298
PUBCHEM_299	[#7]~[#1]	PUBCHEM_299
PUBCHEM_300	[#7]~[#7]	PUBCHEM_300
PUBCHEM_301	[#7]~[#8]	PUBCHEM_301
PUBCHEM_302	[#7]~[#9]	PUBCHEM_302
PUBCHEM_303	[#7]~[#14]	PUBCHEM_303
PUBCHEM_304	[#7]~[#15]	PUBCHEM_304
PUBCHEM_305	[#7]~[#16]	PUBCHEM_305
PUBCHEM_306	[#7]~[#17]	PUBCHEM_306
PUBCHEM_307	[#7]~[#35]	PUBCHEM_307
PUBCHEM_308	[#8]~[#1]	PUBCHEM_308
PUBCHEM_309	[#8]~[#8]	PUBCHEM_309
PUBCHEM_310	[#8]~[#12]	PUBCHEM_310
PUBCHEM_311	[#8]~[#11]	PUBCHEM_311
PUBCHEM_312	[#8]~[#13]	PUBCHEM_312
PUBCHEM_313	[#8]~[#14]	PUBCHEM_313
PUBCHEM_314	[#8]~[#15]	PUBCHEM_314
PUBCHEM_315	[#8]~[#19]	PUBCHEM_315
PUBCHEM_316	[#9]~[#15]	PUBCHEM_316
PUBCHEM_317	[#9]~[#16]	PUBCHEM_317
PUBCHEM_318	[#13]~[#1]	PUBCHEM_318
PUBCHEM_319	[#13]~[#17]	PUBCHEM_319
PUBCHEM_320	[#14]~[#1]	PUBCHEM_320
PUBCHEM_321	[#14]~[#14]	PUBCHEM_321
PUBCHEM_322	[#14]~[#17]	PUBCHEM_322
PUBCHEM_323	[#15]~[#1]	PUBCHEM_323
PUBCHEM_324	[#15]~[#15]	PUBCHEM_324
PUBCHEM_325	[#33]~[#1]	PUBCHEM_325
PUBCHEM_326	[#33]~[#33]	PUBCHEM_326
PUBCHEM_327	[#6](~[#35])(~[#6])	PUBCHEM_327
PUBCHEM_328	[#6](~[#35])(~[#6])(~[#6])	PUBCHEM_328
PUBCHEM_329	[#6](~[#35])(~[#1])	PUBCHEM_329
PUBCHEM_330	[#6](~[#35])(:[#6])	PUBCHEM_330
PUBCHEM_331	[#6](~[#35])(:[#7])	PUBCHEM_331
PUBCHEM_332	[#6](~[#6])(~[#6])	PUBCHEM_332
PUBCHEM_333	[#6](~[#6])(~[#6])(~[#6])	PUBCHEM_333
PUBCHEM_334	[#6](~[#6])(~[#6])(~[#6])(~[#6])	PUBCHEM_334
PUBCHEM_335	[#6](~[#6])(~[#6])(~[#6])(~[#1])	PUBCHEM_335
PUBCHEM_336	[#6](~[#6])(~[#6])(~[#6])(~[#7])	PUBCHEM_336
PUBCHEM_337	[#6](~[#6])(~[#6])(~[#6])(~[#8])	PUBCHEM_337
PUBCHEM_338	[#6](~[#6])(~[#6])(~[#1])(~[#7])	PUBCHEM_338
PUBCHEM_339	[#6](~[#6])(~[#6])(~[#1])(~[#8])	PUBCHEM_339
PUBCHEM_340	[#6](~[#6])(~[#6])(~[#7])	PUBCHEM_340
PUBCHEM_341	[#6](~[#6])(~[#6])(~[#8])	PUBCHEM_341
PUBCHEM_342	[#6](~[#6])(~[#17])	PUBCHEM_342
PUBCHEM_343	[#6](~[#6])(~[#17])(~[#1])	PUBCHEM_343
PUBCHEM_344	[#6](~[#6])(~[#1])	PUBCHEM_344
PUBCHEM_345	[#6](~[#6])(~[#1])(~[#7])	PUBCHEM_345
PUBCHEM_346	[#6](~[#6])(~[#1])(~[#8])	PUBCHEM_346
PUBCHEM_347	[#6](~[#6])(~[#1])(~[#8])(~[#8])	PUBCHEM_347
PUBCHEM_348	[#6](~[#6])(~[#1])(~[#15])	PUBCHEM_348
PUBCHEM_349	[#6](~[#6])(~[#1])(~[#16])	PUBCHEM_349
PUBCHEM_350	[#6](~[#6])(~[#53])	PUBCHEM_350
PUBCHEM_351	[#6](~[#6])(~[#7])	PUBCHEM_351
PUBCHEM_352	[#6](~[#6])(~[#8])	PUBCHEM_352
PUBCHEM_353	[#6](~[#6])(~[#16])	PUBCHEM_353
PUBCHEM_354	[#6](~[#6])(~[#14])	PUBCHEM_354
PUBCHEM_355	[#6](~[#6])(:[#6])	PUBCHEM_355
PUBCHEM_356	[#6](~[#6])(:[#6])(:[#6])	PUBCHEM_356
PUBCHEM_357	[#6](~[#6])(:[#6])(:[#7])	PUBCHEM_357
PUBCHEM_358	[#6](~[#6])(:[#7])	PUBCHEM_358
PUBCHEM_359	[#6](~[#6])(:[#7])(:[#7])	PUBCHEM_359
PUBCHEM_360	[#6](~[#17])(~[#17])	PUBCHEM_360
PUBCHEM_361	[#6](~[#17])(~[#1])	PUBCHEM_361
PUBCHEM_362	[#6](~[#17])(:[#6])	PUBCHEM_362
PUBCHEM_363	[#6](~[#9])(~[#9])	PUBCHEM_363
PUBCHEM_364	[#6](~[#9])(:[#6])	PUBCHEM_364
PUBCHEM_365	[#6](~[#1])(~[#7])	PUBCHEM_365
PUBCHEM_366	[#6](~[#1])(~[#8])	PUBCHEM_366
PUBCHEM_367	[#6](~[#1])(~[#8])(~[#8])	PUBCHEM_367
PUBCHEM_368	[#6](~[#1])(~[#16])	PUBCHEM_368
PUBCHEM_369	[#6](~[#1])(~[#14])	PUBCHEM_369
PUBCHEM_370	[#6](~[#1])(:[#6])	PUBCHEM_370
PUBCHEM_371	[#6](~[#1])(:[#6])(:[#6])	PUBCHEM_371
PUBCHEM_372	[#6](~[#1])(:[#6])(:[#7])	PUBCHEM_372
PUBCHEM_373	[#6](~[#1])(:[#7])	PUBCHEM_373
PUBCHEM_374	[#6](~[#1])(~[#1])(~[#1])	PUBCHEM_374
PUBCHEM_375	[#6](~[#7])(~[#7])	PUBCHEM_375
PUBCHEM_376	[#6](~[#7])(:[#6])	PUBCHEM_376
PUBCHEM_377	[#6](~[#7])(:[#6])(:[#6])	PUBCHEM_377
PUBCHEM_378	[#6](~[#7])(:[#6])(:[#7])	PUBCHEM_378
PUBCHEM_379	[#6](~[#7])(:[#7])	PUBCHEM_379
PUBCHEM_380	[#6](~[#8])(~[#8])	PUBCHEM_380
PUBCHEM_381	[#6](~[#8])(:[#6])	PUBCHEM_381
PUBCHEM_382	[#6](~[#8])(:[#6])(:[#6])	PUBCHEM_382
PUBCHEM_383	[#6](~[#16])(:[#6])	PUBCHEM_383
PUBCHEM_384	[#6](:[#6])(:[#6])	PUBCHEM_384
PUBCHEM_385	[#6](:[#6])(:[#6])(:[#6])	PUBCHEM_385
PUBCHEM_386	[#6](:[#6])(:[#6])(:[#7])	PUBCHEM_386
PUBCHEM_387	[#6](:[#6])(:[#7])	PUBCHEM_387
PUBCHEM_388	[#6](:[#6])(:[#7])(:[#7])	PUBCHEM_388
PUBCHEM_389	[#6](:[#7])(:[#7])	PUBCHEM_389
PUBCHEM_390	[#7](~[#6])(~[#6])	PUBCHEM_390
PUBCHEM_391	[#7](~[#6])(~[#6])(~[#6])	PUBCHEM_391
PUBCHEM_392	[#7](~[#6])(~[#6])(~[#1])	PUBCHEM_392
PUBCHEM_393	[#7](~[#6])(~[#1])	PUBCHEM_393
PUBCHEM_394	[#7](~[#6])(~[#1])(~[#7])	PUBCHEM_394
PUBCHEM_395	[#7](~[#6])(~[#8])	PUBCHEM_395
PUBCHEM_396	[#7](~[#6])(:[#6])	PUBCHEM_396
PUBCHEM_397	[#7](~[#6])(:[#6])(:[#6])	PUBCHEM_397
PUBCHEM_398	[#7](~[#1])(~[#7])	PUBCHEM_398
PUBCHEM_399	[#7](~[#1])(:[#6])	PUBCHEM_399
PUBCHEM_400	[#7](~[#1])(:[#6])(:[#6])	PUBCHEM_400
PUBCHEM_401	[#7](~[#8])(~[#8])	PUBCHEM_401
PUBCHEM_402	[#7](~[#8])(:[#8])	PUBCHEM_402
PUBCHEM_403	[#7](:[#6])(:[#6])	PUBCHEM_403
PUBCHEM_404	[#7](:[#6])(:[#6])(:[#6])	PUBCHEM_404
PUBCHEM_405	[#8](~[#6])(~[#6])	PUBCHEM_405
PUBCHEM_406	[#8](~[#6])(~[#1])	PUBCHEM_406
PUBCHEM_407	[#8](~[#6])(~[#15])	PUBCHEM_407
PUBCHEM_408	[#8](~[#1])(~[#16])	PUBCHEM_408
PUBCHEM_409	[#8](:[#6])(:[#6])	PUBCHEM_409
PUBCHEM_410	[#15](~[#6])(~[#6])	PUBCHEM_410
PUBCHEM_411	[#15](~[#8])(~[#8])	PUBCHEM_411
PUBCHEM_412	[#16](~[#6])(~[#6])	PUBCHEM_412
PUBCHEM_413	[#16](~[#6])(~[#1])	PUBCHEM_413
PUBCHEM_414	[#16](~[#6])(~[#8])	PUBCHEM_414
PUBCHEM_415	[#14](~[#6])(~[#6])	PUBCHEM_415
PUBCHEM_416	"[#6]=,:[#6]"	PUBCHEM_416
PUBCHEM_417	[#6]#[#6]	PUBCHEM_417
PUBCHEM_418	"[#6]=,:[#7]"	PUBCHEM_418
PUBCHEM_419	[#6]#[#7]	PUBCHEM_419
PUBCHEM_420	"[#6]=,:[#8]"	PUBCHEM_420
PUBCHEM_421	"[#6]=,:[#16]"	PUBCHEM_421
PUBCHEM_422	"[#7]=,:[#7]"	PUBCHEM_422
PUBCHEM_423	"[#7]=,:[#8]"	PUBCHEM_423
PUBCHEM_424	"[#7]=,:[#15]"	PUBCHEM_424
PUBCHEM_425	"[#15]=,:[#8]"	PUBCHEM_425
PUBCHEM_426	"[#15]=,:[#15]"	PUBCHEM_426
PUBCHEM_427	[#6](#[#6])([#6])	PUBCHEM_427
PUBCHEM_428	[#6](#[#6])([#1])	PUBCHEM_428
PUBCHEM_429	[#6](#[#7])([#6])	PUBCHEM_429
PUBCHEM_430	"[#6]([#6])([#6])(=,:[#6])"	PUBCHEM_430
PUBCHEM_431	"[#6]([#6])([#6])(=,:[#7])"	PUBCHEM_431
PUBCHEM_432	"[#6]([#6])([#6])(=,:[#8])"	PUBCHEM_432
PUBCHEM_433	"[#6]([#6])([#17])(=,:[#8])"	PUBCHEM_433
PUBCHEM_434	"[#6]([#6])([#1])(=,:[#6])"	PUBCHEM_434
PUBCHEM_435	"[#6]([#6])([#1])(=,:[#7])"	PUBCHEM_435
PUBCHEM_436	"[#6]([#6])([#1])(=,:[#8])"	PUBCHEM_436
PUBCHEM_437	"[#6]([#6])([#7])(=,:[#6])"	PUBCHEM_437
PUBCHEM_438	"[#6]([#6])([#7])(=,:[#7])"	PUBCHEM_438
PUBCHEM_439	"[#6]([#6])([#7])(=,:[#8])"	PUBCHEM_439
PUBCHEM_440	"[#6]([#6])([#8])(=,:[#8])"	PUBCHEM_440
PUBCHEM_441	"[#6]([#6])(=,:[#6])"	PUBCHEM_441
PUBCHEM_442	"[#6]([#6])(=,:[#7])"	PUBCHEM_442
PUBCHEM_443	"[#6]([#6])(=,:[#8])"	PUBCHEM_443
PUBCHEM_444	"[#6]([#17])(=,:[#8])"	PUBCHEM_444
PUBCHEM_445	"[#6]([#1])([#7])(=,:[#6])"	PUBCHEM_445
PUBCHEM_446	"[#6]([#1])(=,:[#6])"	PUBCHEM_446
PUBCHEM_447	"[#6]([#1])(=,:[#7])"	PUBCHEM_447
PUBCHEM_448	"[#6]([#1])(=,:[#8])"	PUBCHEM_448
PUBCHEM_449	"[#6]([#7])(=,:[#6])"	PUBCHEM_449
PUBCHEM_450	"[#6]([#7])(=,:[#7])"	PUBCHEM_450
PUBCHEM_451	"[#6]([#7])(=,:[#8])"	PUBCHEM_451
PUBCHEM_452	"[#6]([#8])(=,:[#8])"	PUBCHEM_452
PUBCHEM_453	"[#7]([#6])(=,:[#6])"	PUBCHEM_453
PUBCHEM_454	"[#7]([#6])(=,:[#8])"	PUBCHEM_454
PUBCHEM_455	"[#7]([#8])(=,:[#8])"	PUBCHEM_455
PUBCHEM_456	"[#15]([#8])(=,:[#8])"	PUBCHEM_456
PUBCHEM_457	"[#16]([#6])(=,:[#8])"	PUBCHEM_457
PUBCHEM_458	"[#16]([#8])(=,:[#8])"	PUBCHEM_458
PUBCHEM_459	"[#16](=,:[#8])(=,:[#8])"	PUBCHEM_459
PUBCHEM_460	[#6][#6][#6]#[#6]	PUBCHEM_460
PUBCHEM_461	"[#8][#6][#6]=,:[#7]"	PUBCHEM_461
PUBCHEM_462	"[#8][#6][#6]=,:[#8]"	PUBCHEM_462
PUBCHEM_463	[#7]:[#6][#16][#1]	PUBCHEM_463
PUBCHEM_464	"[#7][#6][#6]=,:[#6]"	PUBCHEM_464
PUBCHEM_465	"[#8]=,:[#16][#6][#6]"	PUBCHEM_465
PUBCHEM_466	"[#7]#[#6][#6]=,:[#6]"	PUBCHEM_466
PUBCHEM_467	"[#6]=,:[#7][#7][#6]"	PUBCHEM_467
PUBCHEM_468	"[#8]=,:[#16][#6][#7]"	PUBCHEM_468
PUBCHEM_469	[#16][#16][#6]:[#6]	PUBCHEM_469
PUBCHEM_470	"[#6]:[#6][#6]=,:[#6]"	PUBCHEM_470
PUBCHEM_471	[#16]:[#6]:[#6]:[#6]	PUBCHEM_471
PUBCHEM_472	[#6]:[#7]:[#6][#6]	PUBCHEM_472
PUBCHEM_473	[#16][#6]:[#7]:[#6]	PUBCHEM_473
PUBCHEM_474	[#16]:[#6]:[#6]:[#7]	PUBCHEM_474
PUBCHEM_475	"[#16][#6]=,:[#7][#6]"	PUBCHEM_475
PUBCHEM_476	"[#6][#8][#6]=,:[#6]"	PUBCHEM_476
PUBCHEM_477	[#7][#7][#6]:[#6]	PUBCHEM_477
PUBCHEM_478	"[#16][#6]=,:[#7][#1]"	PUBCHEM_478
PUBCHEM_479	[#16][#6][#16][#6]	PUBCHEM_479
PUBCHEM_480	[#6]:[#16]:[#6][#6]	PUBCHEM_480
PUBCHEM_481	[#8][#16][#6]:[#6]	PUBCHEM_481
PUBCHEM_482	[#6]:[#7][#6]:[#6]	PUBCHEM_482
PUBCHEM_483	[#7][#16][#6]:[#6]	PUBCHEM_483
PUBCHEM_484	[#7][#6]:[#7]:[#6]	PUBCHEM_484
PUBCHEM_485	[#7]:[#6]:[#6]:[#7]	PUBCHEM_485
PUBCHEM_486	[#7][#6]:[#7]:[#7]	PUBCHEM_486
PUBCHEM_487	"[#7][#6]=,:[#7][#6]"	PUBCHEM_487
PUBCHEM_488	"[#7][#6]=,:[#7][#1]"	PUBCHEM_488
PUBCHEM_489	[#7][#6][#16][#6]	PUBCHEM_489
PUBCHEM_490	"[#6][#6][#6]=,:[#6]"	PUBCHEM_490
PUBCHEM_491	[#6][#7]:[#6][#1]	PUBCHEM_491
PUBCHEM_492	[#7][#6]:[#8]:[#6]	PUBCHEM_492
PUBCHEM_493	"[#8]=,:[#6][#6]:[#6]"	PUBCHEM_493
PUBCHEM_494	"[#8]=,:[#6][#6]:[#7]"	PUBCHEM_494
PUBCHEM_495	[#6][#7][#6]:[#6]	PUBCHEM_495
PUBCHEM_496	[#7]:[#7][#6][#1]	PUBCHEM_496
PUBCHEM_497	[#8][#6]:[#6]:[#7]	PUBCHEM_497
PUBCHEM_498	"[#8][#6]=,:[#6][#6]"	PUBCHEM_498
PUBCHEM_499	[#7][#6]:[#6]:[#7]	PUBCHEM_499
PUBCHEM_500	[#6][#16][#6]:[#6]	PUBCHEM_500
PUBCHEM_501	[#17][#6]:[#6][#6]	PUBCHEM_501
PUBCHEM_502	"[#7][#6]=,:[#6][#1]"	PUBCHEM_502
PUBCHEM_503	[#17][#6]:[#6][#1]	PUBCHEM_503
PUBCHEM_504	[#7]:[#6]:[#7][#6]	PUBCHEM_504
PUBCHEM_505	[#17][#6]:[#6][#8]	PUBCHEM_505
PUBCHEM_506	[#6][#6]:[#7]:[#6]	PUBCHEM_506
PUBCHEM_507	[#6][#6][#16][#6]	PUBCHEM_507
PUBCHEM_508	"[#16]=,:[#6][#7][#6]"	PUBCHEM_508
PUBCHEM_509	[#35][#6]:[#6][#6]	PUBCHEM_509
PUBCHEM_510	[#1][#7][#7][#1]	PUBCHEM_510
PUBCHEM_511	"[#16]=,:[#6][#7][#1]"	PUBCHEM_511
PUBCHEM_512	[#6][#33][#8][#1]	PUBCHEM_512
PUBCHEM_513	[#16]:[#6]:[#6][#1]	PUBCHEM_513
PUBCHEM_514	[#8][#7][#6][#6]	PUBCHEM_514
PUBCHEM_515	[#7][#7][#6][#6]	PUBCHEM_515
PUBCHEM_516	"[#1][#6]=,:[#6][#1]"	PUBCHEM_516
PUBCHEM_517	[#7][#7][#6][#7]	PUBCHEM_517
PUBCHEM_518	"[#8]=,:[#6][#7][#7]"	PUBCHEM_518
PUBCHEM_519	"[#7]=,:[#6][#7][#6]"	PUBCHEM_519
PUBCHEM_520	"[#6]=,:[#6][#6]:[#6]"	PUBCHEM_520
PUBCHEM_521	[#6]:[#7][#6][#1]	PUBCHEM_521
PUBCHEM_522	[#6][#7][#7][#1]	PUBCHEM_522
PUBCHEM_523	[#7]:[#6]:[#6][#6]	PUBCHEM_523
PUBCHEM_524	"[#6][#6]=,:[#6][#6]"	PUBCHEM_524
PUBCHEM_525	[#33][#6]:[#6][#1]	PUBCHEM_525
PUBCHEM_526	[#17][#6]:[#6][#17]	PUBCHEM_526
PUBCHEM_527	[#6]:[#6]:[#7][#1]	PUBCHEM_527
PUBCHEM_528	[#1][#7][#6][#1]	PUBCHEM_528
PUBCHEM_529	[#17][#6][#6][#17]	PUBCHEM_529
PUBCHEM_530	[#7]:[#6][#6]:[#6]	PUBCHEM_530
PUBCHEM_531	[#16][#6]:[#6][#6]	PUBCHEM_531
PUBCHEM_532	[#16][#6]:[#6][#1]	PUBCHEM_532
PUBCHEM_533	[#16][#6]:[#6][#7]	PUBCHEM_533
PUBCHEM_534	[#16][#6]:[#6][#8]	PUBCHEM_534
PUBCHEM_535	"[#8]=,:[#6][#6][#6]"	PUBCHEM_535
PUBCHEM_536	"[#8]=,:[#6][#6][#7]"	PUBCHEM_536
PUBCHEM_537	"[#8]=,:[#6][#6][#8]"	PUBCHEM_537
PUBCHEM_538	"[#7]=,:[#6][#6][#6]"	PUBCHEM_538
PUBCHEM_539	"[#7]=,:[#6][#6][#1]"	PUBCHEM_539
PUBCHEM_540	[#6][#7][#6][#1]	PUBCHEM_540
PUBCHEM_541	[#8][#6]:[#6][#6]	PUBCHEM_541
PUBCHEM_542	[#8][#6]:[#6][#1]	PUBCHEM_542
PUBCHEM_543	[#8][#6]:[#6][#7]	PUBCHEM_543
PUBCHEM_544	[#8][#6]:[#6][#8]	PUBCHEM_544
PUBCHEM_545	[#7][#6]:[#6][#6]	PUBCHEM_545
PUBCHEM_546	[#7][#6]:[#6][#1]	PUBCHEM_546
PUBCHEM_547	[#7][#6]:[#6][#7]	PUBCHEM_547
PUBCHEM_548	[#8][#6][#6]:[#6]	PUBCHEM_548
PUBCHEM_549	[#7][#6][#6]:[#6]	PUBCHEM_549
PUBCHEM_550	[#17][#6][#6][#6]	PUBCHEM_550
PUBCHEM_551	[#17][#6][#6][#8]	PUBCHEM_551
PUBCHEM_552	[#6]:[#6][#6]:[#6]	PUBCHEM_552
PUBCHEM_553	"[#8]=,:[#6][#6]=,:[#6]"	PUBCHEM_553
PUBCHEM_554	[#35][#6][#6][#6]	PUBCHEM_554
PUBCHEM_555	"[#7]=,:[#6][#6]=,:[#6]"	PUBCHEM_555
PUBCHEM_556	"[#6]=,:[#6][#6][#6]"	PUBCHEM_556
PUBCHEM_557	[#7]:[#6][#8][#1]	PUBCHEM_557
PUBCHEM_558	"[#8]=,:[#7][#6]:[#6]"	PUBCHEM_558
PUBCHEM_559	[#8][#6][#7][#1]	PUBCHEM_559
PUBCHEM_560	[#7][#6][#7][#6]	PUBCHEM_560
PUBCHEM_561	"[#17][#6][#6]=,:[#8]"	PUBCHEM_561
PUBCHEM_562	"[#35][#6][#6]=,:[#8]"	PUBCHEM_562
PUBCHEM_563	[#8][#6][#8][#6]	PUBCHEM_563
PUBCHEM_564	"[#6]=,:[#6][#6]=,:[#6]"	PUBCHEM_564
PUBCHEM_565	[#6]:[#6][#8][#6]	PUBCHEM_565
PUBCHEM_566	[#8][#6][#6][#7]	PUBCHEM_566
PUBCHEM_567	[#8][#6][#6][#8]	PUBCHEM_567
PUBCHEM_568	[#7]#[#6][#6][#6]	PUBCHEM_568
PUBCHEM_569	[#7][#6][#6][#7]	PUBCHEM_569
PUBCHEM_570	[#6]:[#6][#6][#6]	PUBCHEM_570
PUBCHEM_571	[#1][#6][#8][#1]	PUBCHEM_571
PUBCHEM_572	[#7]:[#6]:[#7]:[#6]	PUBCHEM_572
PUBCHEM_573	"[#8][#6][#6]=,:[#6]"	PUBCHEM_573
PUBCHEM_574	[#8][#6][#6]:[#6][#6]	PUBCHEM_574
PUBCHEM_575	[#8][#6][#6]:[#6][#8]	PUBCHEM_575
PUBCHEM_576	"[#7]=,:[#6][#6]:[#6][#1]"	PUBCHEM_576
PUBCHEM_577	[#6]:[#6][#7][#6]:[#6]	PUBCHEM_577
PUBCHEM_578	[#6][#6]:[#6][#6]:[#6]	PUBCHEM_578
PUBCHEM_579	"[#8]=,:[#6][#6][#6][#6]"	PUBCHEM_579
PUBCHEM_580	"[#8]=,:[#6][#6][#6][#7]"	PUBCHEM_580
PUBCHEM_581	"[#8]=,:[#6][#6][#6][#8]"	PUBCHEM_581
PUBCHEM_582	[#6][#6][#6][#6][#6]	PUBCHEM_582
PUBCHEM_583	[#17][#6]:[#6][#8][#6]	PUBCHEM_583
PUBCHEM_584	"[#6]:[#6][#6]=,:[#6][#6]"	PUBCHEM_584
PUBCHEM_585	[#6][#6]:[#6][#7][#6]	PUBCHEM_585
PUBCHEM_586	[#6][#16][#6][#6][#6]	PUBCHEM_586
PUBCHEM_587	[#7][#6]:[#6][#8][#1]	PUBCHEM_587
PUBCHEM_588	"[#8]=,:[#6][#6][#6]=,:[#8]"	PUBCHEM_588
PUBCHEM_589	[#6][#6]:[#6][#8][#6]	PUBCHEM_589
PUBCHEM_590	[#6][#6]:[#6][#8][#1]	PUBCHEM_590
PUBCHEM_591	[#17][#6][#6][#6][#6]	PUBCHEM_591
PUBCHEM_592	[#7][#6][#6][#6][#6]	PUBCHEM_592
PUBCHEM_593	[#7][#6][#6][#6][#7]	PUBCHEM_593
PUBCHEM_594	"[#6][#8][#6][#6]=,:[#6]"	PUBCHEM_594
PUBCHEM_595	[#6]:[#6][#6][#6][#6]	PUBCHEM_595
PUBCHEM_596	"[#7]=,:[#6][#7][#6][#6]"	PUBCHEM_596
PUBCHEM_597	"[#8]=,:[#6][#6][#6]:[#6]"	PUBCHEM_597
PUBCHEM_598	[#17][#6]:[#6]:[#6][#6]	PUBCHEM_598
PUBCHEM_599	"[#1][#6][#6]=,:[#6][#1]"	PUBCHEM_599
PUBCHEM_600	[#7][#6]:[#6]:[#6][#6]	PUBCHEM_600
PUBCHEM_601	[#7][#6]:[#6]:[#6][#7]	PUBCHEM_601
PUBCHEM_602	"[#8]=,:[#6][#6][#7][#6]"	PUBCHEM_602
PUBCHEM_603	[#6][#6]:[#6]:[#6][#6]	PUBCHEM_603
PUBCHEM_604	[#6][#8][#6][#6]:[#6]	PUBCHEM_604
PUBCHEM_605	"[#8]=,:[#6][#6][#8][#6]"	PUBCHEM_605
PUBCHEM_606	[#8][#6]:[#6][#6][#6]	PUBCHEM_606
PUBCHEM_607	[#7][#6][#6][#6]:[#6]	PUBCHEM_607
PUBCHEM_608	[#6][#6][#6][#6]:[#6]	PUBCHEM_608
PUBCHEM_609	[#17][#6][#6][#7][#6]	PUBCHEM_609
PUBCHEM_610	[#6][#8][#6][#8][#6]	PUBCHEM_610
PUBCHEM_611	[#7][#6][#6][#7][#6]	PUBCHEM_611
PUBCHEM_612	[#7][#6][#8][#6][#6]	PUBCHEM_612
PUBCHEM_613	[#6][#7][#6][#6][#6]	PUBCHEM_613
PUBCHEM_614	[#6][#6][#8][#6][#6]	PUBCHEM_614
PUBCHEM_615	[#7][#6][#6][#8][#6]	PUBCHEM_615
PUBCHEM_616	[#6]:[#6]:[#7]:[#7]:[#6]	PUBCHEM_616
PUBCHEM_617	[#6][#6][#6][#8][#1]	PUBCHEM_617
PUBCHEM_618	[#6]:[#6][#6][#6]:[#6]	PUBCHEM_618
PUBCHEM_619	"[#8][#6][#6]=,:[#6][#6]"	PUBCHEM_619
PUBCHEM_620	[#6]:[#6][#8][#6][#6]	PUBCHEM_620
PUBCHEM_621	[#7][#6]:[#6]:[#6]:[#7]	PUBCHEM_621
PUBCHEM_622	"[#8]=,:[#6][#8][#6]:[#6]"	PUBCHEM_622
PUBCHEM_623	"[#8]=,:[#6][#6]:[#6][#6]"	PUBCHEM_623
PUBCHEM_624	"[#8]=,:[#6][#6]:[#6][#7]"	PUBCHEM_624
PUBCHEM_625	"[#8]=,:[#6][#6]:[#6][#8]"	PUBCHEM_625
PUBCHEM_626	[#6][#8][#6]:[#6][#6]	PUBCHEM_626
PUBCHEM_627	"[#8]=,:[#33][#6]:[#6]:[#6]"	PUBCHEM_627
PUBCHEM_628	[#6][#7][#6][#6]:[#6]	PUBCHEM_628
PUBCHEM_629	[#16][#6]:[#6]:[#6][#7]	PUBCHEM_629
PUBCHEM_630	[#8][#6]:[#6][#8][#6]	PUBCHEM_630
PUBCHEM_631	[#8][#6]:[#6][#8][#1]	PUBCHEM_631
PUBCHEM_632	[#6][#6][#8][#6]:[#6]	PUBCHEM_632
PUBCHEM_633	[#7][#6][#6]:[#6][#6]	PUBCHEM_633
PUBCHEM_634	[#6][#6][#6]:[#6][#6]	PUBCHEM_634
PUBCHEM_635	[#7][#7][#6][#7][#1]	PUBCHEM_635
PUBCHEM_636	[#6][#7][#6][#7][#6]	PUBCHEM_636
PUBCHEM_637	[#8][#6][#6][#6][#6]	PUBCHEM_637
PUBCHEM_638	[#8][#6][#6][#6][#7]	PUBCHEM_638
PUBCHEM_639	[#8][#6][#6][#6][#8]	PUBCHEM_639
PUBCHEM_640	"[#6]=,:[#6][#6][#6][#6]"	PUBCHEM_640
PUBCHEM_641	"[#8][#6][#6][#6]=,:[#6]"	PUBCHEM_641
PUBCHEM_642	"[#8][#6][#6][#6]=,:[#8]"	PUBCHEM_642
PUBCHEM_643	[#1][#6][#6][#7][#1]	PUBCHEM_643
PUBCHEM_644	"[#6][#6]=,:[#7][#7][#6]"	PUBCHEM_644
PUBCHEM_645	"[#8]=,:[#6][#7][#6][#6]"	PUBCHEM_645
PUBCHEM_646	"[#8]=,:[#6][#7][#6][#1]"	PUBCHEM_646
PUBCHEM_647	"[#8]=,:[#6][#7][#6][#7]"	PUBCHEM_647
PUBCHEM_648	"[#8]=,:[#7][#6]:[#6][#7]"	PUBCHEM_648
PUBCHEM_649	"[#8]=,:[#7][#6]:[#6][#8]"	PUBCHEM_649
PUBCHEM_650	"[#8]=,:[#6][#7][#6]=,:[#8]"	PUBCHEM_650
PUBCHEM_651	[#8][#6]:[#6]:[#6][#6]	PUBCHEM_651
PUBCHEM_652	[#8][#6]:[#6]:[#6][#7]	PUBCHEM_652
PUBCHEM_653	[#8][#6]:[#6]:[#6][#8]	PUBCHEM_653
PUBCHEM_654	[#7][#6][#7][#6][#6]	PUBCHEM_654
PUBCHEM_655	[#8][#6][#6][#6]:[#6]	PUBCHEM_655
PUBCHEM_656	[#6][#6][#7][#6][#6]	PUBCHEM_656
PUBCHEM_657	[#6][#7][#6]:[#6][#6]	PUBCHEM_657
PUBCHEM_658	[#6][#6][#16][#6][#6]	PUBCHEM_658
PUBCHEM_659	[#8][#6][#6][#7][#6]	PUBCHEM_659
PUBCHEM_660	"[#6][#6]=,:[#6][#6][#6]"	PUBCHEM_660
PUBCHEM_661	[#8][#6][#8][#6][#6]	PUBCHEM_661
PUBCHEM_662	[#8][#6][#6][#8][#6]	PUBCHEM_662
PUBCHEM_663	[#8][#6][#6][#8][#1]	PUBCHEM_663
PUBCHEM_664	"[#6][#6]=,:[#6][#6]=,:[#6]"	PUBCHEM_664
PUBCHEM_665	[#7][#6]:[#6][#6][#6]	PUBCHEM_665
PUBCHEM_666	"[#6]=,:[#6][#6][#8][#6]"	PUBCHEM_666
PUBCHEM_667	"[#6]=,:[#6][#6][#8][#1]"	PUBCHEM_667
PUBCHEM_668	[#6][#6]:[#6][#6][#6]	PUBCHEM_668
PUBCHEM_669	"[#17][#6]:[#6][#6]=,:[#8]"	PUBCHEM_669
PUBCHEM_670	[#35][#6]:[#6]:[#6][#6]	PUBCHEM_670
PUBCHEM_671	"[#8]=,:[#6][#6]=,:[#6][#6]"	PUBCHEM_671
PUBCHEM_672	"[#8]=,:[#6][#6]=,:[#6][#1]"	PUBCHEM_672
PUBCHEM_673	"[#8]=,:[#6][#6]=,:[#6][#7]"	PUBCHEM_673
PUBCHEM_674	[#7][#6][#7][#6]:[#6]	PUBCHEM_674
PUBCHEM_675	[#35][#6][#6][#6]:[#6]	PUBCHEM_675
PUBCHEM_676	[#7]#[#6][#6][#6][#6]	PUBCHEM_676
PUBCHEM_677	"[#6][#6]=,:[#6][#6]:[#6]"	PUBCHEM_677
PUBCHEM_678	"[#6][#6][#6]=,:[#6][#6]"	PUBCHEM_678
PUBCHEM_679	[#6][#6][#6][#6][#6][#6]	PUBCHEM_679
PUBCHEM_680	[#8][#6][#6][#6][#6][#6]	PUBCHEM_680
PUBCHEM_681	[#8][#6][#6][#6][#6][#8]	PUBCHEM_681
PUBCHEM_682	[#8][#6][#6][#6][#6][#7]	PUBCHEM_682
PUBCHEM_683	[#7][#6][#6][#6][#6][#6]	PUBCHEM_683
PUBCHEM_684	"[#8]=,:[#6][#6][#6][#6][#6]"	PUBCHEM_684
PUBCHEM_685	"[#8]=,:[#6][#6][#6][#6][#7]"	PUBCHEM_685
PUBCHEM_686	"[#8]=,:[#6][#6][#6][#6][#8]"	PUBCHEM_686
PUBCHEM_687	"[#8]=,:[#6][#6][#6][#6]=,:[#8]"	PUBCHEM_687
PUBCHEM_688	[#6][#6][#6][#6][#6][#6][#6]	PUBCHEM_688
PUBCHEM_689	[#8][#6][#6][#6][#6][#6][#6]	PUBCHEM_689
PUBCHEM_690	[#8][#6][#6][#6][#6][#6][#8]	PUBCHEM_690
PUBCHEM_691	[#8][#6][#6][#6][#6][#6][#7]	PUBCHEM_691
PUBCHEM_692	"[#8]=,:[#6][#6][#6][#6][#6][#6]"	PUBCHEM_692
PUBCHEM_693	"[#8]=,:[#6][#6][#6][#6][#6][#8]"	PUBCHEM_693
PUBCHEM_694	"[#8]=,:[#6][#6][#6][#6][#6]=,:[#8]"	PUBCHEM_694
PUBCHEM_695	"[#8]=,:[#6][#6][#6][#6][#6][#7]"	PUBCHEM_695
PUBCHEM_696	[#6][#6][#6][#6][#6][#6][#6][#6]	PUBCHEM_696
PUBCHEM_697	[#6][#6][#6][#6][#6][#6]([#6])[#6]	PUBCHEM_697
PUBCHEM_698	[#8][#6][#6][#6][#6][#6][#6][#6]	PUBCHEM_698
PUBCHEM_699	[#8][#6][#6][#6][#6][#6]([#6])[#6]	PUBCHEM_699
PUBCHEM_700	[#8][#6][#6][#6][#6][#6][#8][#6]	PUBCHEM_700
PUBCHEM_701	[#8][#6][#6][#6][#6][#6]([#8])[#6]	PUBCHEM_701
PUBCHEM_702	[#8][#6][#6][#6][#6][#6][#7][#6]	PUBCHEM_702
PUBCHEM_703	[#8][#6][#6][#6][#6][#6]([#7])[#6]	PUBCHEM_703
PUBCHEM_704	"[#8]=,:[#6][#6][#6][#6][#6][#6][#6]"	PUBCHEM_704
PUBCHEM_705	"[#8]=,:[#6][#6][#6][#6][#6]([#8])[#6]"	PUBCHEM_705
PUBCHEM_706	"[#8]=,:[#6][#6][#6][#6][#6](=,:[#8])[#6]"	PUBCHEM_706
PUBCHEM_707	"[#8]=,:[#6][#6][#6][#6][#6]([#7])[#6]"	PUBCHEM_707
PUBCHEM_708	[#6][#6]([#6])[#6][#6]	PUBCHEM_708
PUBCHEM_709	[#6][#6]([#6])[#6][#6][#6]	PUBCHEM_709
PUBCHEM_710	[#6][#6][#6]([#6])[#6][#6]	PUBCHEM_710
PUBCHEM_711	[#6][#6]([#6])([#6])[#6][#6]	PUBCHEM_711
PUBCHEM_712	[#6][#6]([#6])[#6]([#6])[#6]	PUBCHEM_712
PUBCHEM_713	[#6]c1ccc([#6])cc1	PUBCHEM_713
PUBCHEM_714	[#6]c1ccc([#8])cc1	PUBCHEM_714
PUBCHEM_715	[#6]c1ccc([#16])cc1	PUBCHEM_715
PUBCHEM_716	[#6]c1ccc([#7])cc1	PUBCHEM_716
PUBCHEM_717	[#6]c1ccc([#17])cc1	PUBCHEM_717
PUBCHEM_718	[#6]c1ccc([#35])cc1	PUBCHEM_718
PUBCHEM_719	[#8]c1ccc([#8])cc1	PUBCHEM_719
PUBCHEM_720	[#8]c1ccc([#16])cc1	PUBCHEM_720
PUBCHEM_721	[#8]c1ccc([#7])cc1	PUBCHEM_721
PUBCHEM_722	[#8]c1ccc([#17])cc1	PUBCHEM_722
PUBCHEM_723	[#8]c1ccc([#35])cc1	PUBCHEM_723
PUBCHEM_724	[#16]c1ccc([#16])cc1	PUBCHEM_724
PUBCHEM_725	[#16]c1ccc([#7])cc1	PUBCHEM_725
PUBCHEM_726	[#16]c1ccc([#17])cc1	PUBCHEM_726
PUBCHEM_727	[#16]c1ccc([#35])cc1	PUBCHEM_727
PUBCHEM_728	[#7]c1ccc([#7])cc1	PUBCHEM_728
PUBCHEM_729	[#7]c1ccc([#17])cc1	PUBCHEM_729
PUBCHEM_730	[#7]c1ccc([#35])cc1	PUBCHEM_730
PUBCHEM_731	[#17]c1ccc([#17])cc1	PUBCHEM_731
PUBCHEM_732	[#17]c1ccc([#35])cc1	PUBCHEM_732
PUBCHEM_733	[#35]c1ccc([#35])cc1	PUBCHEM_733
PUBCHEM_734	[#6]c1cc([#6])ccc1	PUBCHEM_734
PUBCHEM_735	[#6]c1cc([#8])ccc1	PUBCHEM_735
PUBCHEM_736	[#6]c1cc([#16])ccc1	PUBCHEM_736
PUBCHEM_737	[#6]c1cc([#7])ccc1	PUBCHEM_737
PUBCHEM_738	[#6]c1cc([#17])ccc1	PUBCHEM_738
PUBCHEM_739	[#6]c1cc([#35])ccc1	PUBCHEM_739
PUBCHEM_740	[#8]c1cc([#8])ccc1	PUBCHEM_740
PUBCHEM_741	[#8]c1cc([#16])ccc1	PUBCHEM_741
PUBCHEM_742	[#8]c1cc([#7])ccc1	PUBCHEM_742
PUBCHEM_743	[#8]c1cc([#17])ccc1	PUBCHEM_743
PUBCHEM_744	[#8]c1cc([#35])ccc1	PUBCHEM_744
PUBCHEM_745	[#16]c1cc([#16])ccc1	PUBCHEM_745
PUBCHEM_746	[#16]c1cc([#7])ccc1	PUBCHEM_746
PUBCHEM_747	[#16]c1cc([#17])ccc1	PUBCHEM_747
PUBCHEM_748	[#16]c1cc([#35])ccc1	PUBCHEM_748
PUBCHEM_749	[#7]c1cc([#7])ccc1	PUBCHEM_749
PUBCHEM_750	[#7]c1cc([#17])ccc1	PUBCHEM_750
PUBCHEM_751	[#7]c1cc([#35])ccc1	PUBCHEM_751
PUBCHEM_752	[#17]c1cc([#17])ccc1	PUBCHEM_752
PUBCHEM_753	[#17]c1cc([#35])ccc1	PUBCHEM_753
PUBCHEM_754	[#35]c1cc([#35])ccc1	PUBCHEM_754
PUBCHEM_755	[#6]c1c([#6])cccc1	PUBCHEM_755
PUBCHEM_756	[#6]c1c([#8])cccc1	PUBCHEM_756
PUBCHEM_757	[#6]c1c([#16])cccc1	PUBCHEM_757
PUBCHEM_758	[#6]c1c([#7])cccc1	PUBCHEM_758
PUBCHEM_759	[#6]c1c([#17])cccc1	PUBCHEM_759
PUBCHEM_760	[#6]c1c([#35])cccc1	PUBCHEM_760
PUBCHEM_761	[#8]c1c([#8])cccc1	PUBCHEM_761
PUBCHEM_762	[#8]c1c([#16])cccc1	PUBCHEM_762
PUBCHEM_763	[#8]c1c([#7])cccc1	PUBCHEM_763
PUBCHEM_764	[#8]c1c([#17])cccc1	PUBCHEM_764
PUBCHEM_765	[#8]c1c([#35])cccc1	PUBCHEM_765
PUBCHEM_766	[#16]c1c([#16])cccc1	PUBCHEM_766
PUBCHEM_767	[#16]c1c([#7])cccc1	PUBCHEM_767
PUBCHEM_768	[#16]c1c([#17])cccc1	PUBCHEM_768
PUBCHEM_769	[#16]c1c([#35])cccc1	PUBCHEM_769
PUBCHEM_770	[#7]c1c([#7])cccc1	PUBCHEM_770
PUBCHEM_771	[#7]c1c([#17])cccc1	PUBCHEM_771
PUBCHEM_772	[#7]c1c([#35])cccc1	PUBCHEM_772
PUBCHEM_773	[#17]c1c([#17])cccc1	PUBCHEM_773
PUBCHEM_774	[#17]c1c([#35])cccc1	PUBCHEM_774
PUBCHEM_775	[#35]c1c([#35])cccc1	PUBCHEM_775
PUBCHEM_776	[#6][#6]1[#6][#6][#6]([#6])[#6][#6]1	PUBCHEM_776
PUBCHEM_777	[#6][#6]1[#6][#6][#6]([#8])[#6][#6]1	PUBCHEM_777
PUBCHEM_778	[#6][#6]1[#6][#6][#6]([#16])[#6][#6]1	PUBCHEM_778
PUBCHEM_779	[#6][#6]1[#6][#6][#6]([#7])[#6][#6]1	PUBCHEM_779
PUBCHEM_780	[#6][#6]1[#6][#6][#6]([#17])[#6][#6]1	PUBCHEM_780
PUBCHEM_781	[#6][#6]1[#6][#6][#6]([#35])[#6][#6]1	PUBCHEM_781
PUBCHEM_782	[#8][#6]1[#6][#6][#6]([#8])[#6][#6]1	PUBCHEM_782
PUBCHEM_783	[#8][#6]1[#6][#6][#6]([#16])[#6][#6]1	PUBCHEM_783
PUBCHEM_784	[#8][#6]1[#6][#6][#6]([#7])[#6][#6]1	PUBCHEM_784
PUBCHEM_785	[#8][#6]1[#6][#6][#6]([#17])[#6][#6]1	PUBCHEM_785
PUBCHEM_786	[#8][#6]1[#6][#6][#6]([#35])[#6][#6]1	PUBCHEM_786
PUBCHEM_787	[#16][#6]1[#6][#6][#6]([#16])[#6][#6]1	PUBCHEM_787
PUBCHEM_788	[#16][#6]1[#6][#6][#6]([#7])[#6][#6]1	PUBCHEM_788
PUBCHEM_789	[#16][#6]1[#6][#6][#6]([#17])[#6][#6]1	PUBCHEM_789
PUBCHEM_790	[#16][#6]1[#6][#6][#6]([#35])[#6][#6]1	PUBCHEM_790
PUBCHEM_791	[#7][#6]1[#6][#6][#6]([#7])[#6][#6]1	PUBCHEM_791
PUBCHEM_792	[#7][#6]1[#6][#6][#6]([#17])[#6][#6]1	PUBCHEM_792
PUBCHEM_793	[#7][#6]1[#6][#6][#6]([#35])[#6][#6]1	PUBCHEM_793
PUBCHEM_794	[#17][#6]1[#6][#6][#6]([#17])[#6][#6]1	PUBCHEM_794
PUBCHEM_795	[#17][#6]1[#6][#6][#6]([#35])[#6][#6]1	PUBCHEM_795
PUBCHEM_796	[#35][#6]1[#6][#6][#6]([#35])[#6][#6]1	PUBCHEM_796
PUBCHEM_797	[#6][#6]1[#6][#6]([#6])[#6][#6][#6]1	PUBCHEM_797
PUBCHEM_798	[#6][#6]1[#6][#6]([#8])[#6][#6][#6]1	PUBCHEM_798
PUBCHEM_799	[#6][#6]1[#6][#6]([#16])[#6][#6][#6]1	PUBCHEM_799
PUBCHEM_800	[#6][#6]1[#6][#6]([#7])[#6][#6][#6]1	PUBCHEM_800
PUBCHEM_801	[#6][#6]1[#6][#6]([#17])[#6][#6][#6]1	PUBCHEM_801
PUBCHEM_802	[#6][#6]1[#6][#6]([#35])[#6][#6][#6]1	PUBCHEM_802
PUBCHEM_803	[#8][#6]1[#6][#6]([#8])[#6][#6][#6]1	PUBCHEM_803
PUBCHEM_804	[#8][#6]1[#6][#6]([#16])[#6][#6][#6]1	PUBCHEM_804
PUBCHEM_805	[#8][#6]1[#6][#6]([#7])[#6][#6][#6]1	PUBCHEM_805
PUBCHEM_806	[#8][#6]1[#6][#6]([#17])[#6][#6][#6]1	PUBCHEM_806
PUBCHEM_807	[#8][#6]1[#6][#6]([#35])[#6][#6][#6]1	PUBCHEM_807
PUBCHEM_808	[#16][#6]1[#6][#6]([#16])[#6][#6][#6]1	PUBCHEM_808
PUBCHEM_809	[#16][#6]1[#6][#6]([#7])[#6][#6][#6]1	PUBCHEM_809
PUBCHEM_810	[#16][#6]1[#6][#6]([#17])[#6][#6][#6]1	PUBCHEM_810
PUBCHEM_811	[#16][#6]1[#6][#6]([#35])[#6][#6][#6]1	PUBCHEM_811
PUBCHEM_812	[#7][#6]1[#6][#6]([#7])[#6][#6][#6]1	PUBCHEM_812
PUBCHEM_813	[#7][#6]1[#6][#6]([#17])[#6][#6][#6]1	PUBCHEM_813
PUBCHEM_814	[#7][#6]1[#6][#6]([#35])[#6][#6][#6]1	PUBCHEM_814
PUBCHEM_815	[#17][#6]1[#6][#6]([#17])[#6][#6][#6]1	PUBCHEM_815
PUBCHEM_816	[#17][#6]1[#6][#6]([#35])[#6][#6][#6]1	PUBCHEM_816
PUBCHEM_817	[#35][#6]1[#6][#6]([#35])[#6][#6][#6]1	PUBCHEM_817
PUBCHEM_818	[#6][#6]1[#6]([#6])[#6][#6][#6][#6]1	PUBCHEM_818
PUBCHEM_819	[#6][#6]1[#6]([#8])[#6][#6][#6][#6]1	PUBCHEM_819
PUBCHEM_820	[#6][#6]1[#6]([#16])[#6][#6][#6][#6]1	PUBCHEM_820
PUBCHEM_821	[#6][#6]1[#6]([#7])[#6][#6][#6][#6]1	PUBCHEM_821
PUBCHEM_822	[#6][#6]1[#6]([#17])[#6][#6][#6][#6]1	PUBCHEM_822
PUBCHEM_823	[#6][#6]1[#6]([#35])[#6][#6][#6][#6]1	PUBCHEM_823
PUBCHEM_824	[#8][#6]1[#6]([#8])[#6][#6][#6][#6]1	PUBCHEM_824
PUBCHEM_825	[#8][#6]1[#6]([#16])[#6][#6][#6][#6]1	PUBCHEM_825
PUBCHEM_826	[#8][#6]1[#6]([#7])[#6][#6][#6][#6]1	PUBCHEM_826
PUBCHEM_827	[#8][#6]1[#6]([#17])[#6][#6][#6][#6]1	PUBCHEM_827
PUBCHEM_828	[#8][#6]1[#6]([#35])[#6][#6][#6][#6]1	PUBCHEM_828
PUBCHEM_829	[#16][#6]1[#6]([#16])[#6][#6][#6][#6]1	PUBCHEM_829
PUBCHEM_830	[#16][#6]1[#6]([#7])[#6][#6][#6][#6]1	PUBCHEM_830
PUBCHEM_831	[#16][#6]1[#6]([#17])[#6][#6][#6][#6]1	PUBCHEM_831
PUBCHEM_832	[#16][#6]1[#6]([#35])[#6][#6][#6][#6]1	PUBCHEM_832
PUBCHEM_833	[#7][#6]1[#6]([#7])[#6][#6][#6][#6]1	PUBCHEM_833
PUBCHEM_834	[#7][#6]1[#6]([#17])[#6][#6][#6][#6]1	PUBCHEM_834
PUBCHEM_835	[#7][#6]1[#6]([#35])[#6][#6][#6][#6]1	PUBCHEM_835
PUBCHEM_836	[#17][#6]1[#6]([#17])[#6][#6][#6][#6]1	PUBCHEM_836
PUBCHEM_837	[#17][#6]1[#6]([#35])[#6][#6][#6][#6]1	PUBCHEM_837
PUBCHEM_838	[#35][#6]1[#6]([#35])[#6][#6][#6][#6]1	PUBCHEM_838
PUBCHEM_839	[#6][#6]1[#6][#6]([#6])[#6][#6]1	PUBCHEM_839
PUBCHEM_840	[#6][#6]1[#6][#6]([#8])[#6][#6]1	PUBCHEM_840
PUBCHEM_841	[#6][#6]1[#6][#6]([#16])[#6][#6]1	PUBCHEM_841
PUBCHEM_842	[#6][#6]1[#6][#6]([#7])[#6][#6]1	PUBCHEM_842
PUBCHEM_843	[#6][#6]1[#6][#6]([#17])[#6][#6]1	PUBCHEM_843
PUBCHEM_844	[#6][#6]1[#6][#6]([#35])[#6][#6]1	PUBCHEM_844
PUBCHEM_845	[#8][#6]1[#6][#6]([#8])[#6][#6]1	PUBCHEM_845
PUBCHEM_846	[#8][#6]1[#6][#6]([#16])[#6][#6]1	PUBCHEM_846
PUBCHEM_847	[#8][#6]1[#6][#6]([#7])[#6][#6]1	PUBCHEM_847
PUBCHEM_848	[#8][#6]1[#6][#6]([#17])[#6][#6]1	PUBCHEM_848
PUBCHEM_849	[#8][#6]1[#6][#6]([#35])[#6][#6]1	PUBCHEM_849
PUBCHEM_850	[#16][#6]1[#6][#6]([#16])[#6][#6]1	PUBCHEM_850
PUBCHEM_851	[#16][#6]1[#6][#6]([#7])[#6][#6]1	PUBCHEM_851
PUBCHEM_852	[#16][#6]1[#6][#6]([#17])[#6][#6]1	PUBCHEM_852
PUBCHEM_853	[#16][#6]1[#6][#6]([#35])[#6][#6]1	PUBCHEM_853
PUBCHEM_854	[#7][#6]1[#6][#6]([#7])[#6][#6]1	PUBCHEM_854
PUBCHEM_855	[#7][#6]1[#6][#6]([#17])[#6][#6]1	PUBCHEM_855
PUBCHEM_856	[#7][#6]1[#6][#6]([#35])[#6][#6]1	PUBCHEM_856
PUBCHEM_857	[#17][#6]1[#6][#6]([#17])[#6][#6]1	PUBCHEM_857
PUBCHEM_858	[#17][#6]1[#6][#6]([#35])[#6][#6]1	PUBCHEM_858
PUBCHEM_859	[#35][#6]1[#6][#6]([#35])[#6][#6]1	PUBCHEM_859
PUBCHEM_860	[#6][#6]1[#6]([#6])[#6][#6][#6]1	PUBCHEM_860
PUBCHEM_861	[#6][#6]1[#6]([#8])[#6][#6][#6]1	PUBCHEM_861
PUBCHEM_862	[#6][#6]1[#6]([#16])[#6][#6][#6]1	PUBCHEM_862
PUBCHEM_863	[#6][#6]1[#6]([#7])[#6][#6][#6]1	PUBCHEM_863
PUBCHEM_864	[#6][#6]1[#6]([#17])[#6][#6][#6]1	PUBCHEM_864
PUBCHEM_865	[#6][#6]1[#6]([#35])[#6][#6][#6]1	PUBCHEM_865
PUBCHEM_866	[#8][#6]1[#6]([#8])[#6][#6][#6]1	PUBCHEM_866
PUBCHEM_867	[#8][#6]1[#6]([#16])[#6][#6][#6]1	PUBCHEM_867
PUBCHEM_868	[#8][#6]1[#6]([#7])[#6][#6][#6]1	PUBCHEM_868
PUBCHEM_869	[#8][#6]1[#6]([#17])[#6][#6][#6]1	PUBCHEM_869
PUBCHEM_870	[#8][#6]1[#6]([#35])[#6][#6][#6]1	PUBCHEM_870
PUBCHEM_871	[#16][#6]1[#6]([#16])[#6][#6][#6]1	PUBCHEM_871
PUBCHEM_872	[#16][#6]1[#6]([#7])[#6][#6][#6]1	PUBCHEM_872
PUBCHEM_873	[#16][#6]1[#6]([#17])[#6][#6][#6]1	PUBCHEM_873
PUBCHEM_874	[#16][#6]1[#6]([#35])[#6][#6][#6]1	PUBCHEM_874
PUBCHEM_875	[#7][#6]1[#6]([#7])[#6][#6][#6]1	PUBCHEM_875
PUBCHEM_876	[#7][#6]1[#6]([#17])[#6][#6]1	PUBCHEM_876
PUBCHEM_877	[#7][#6]1[#6]([#35])[#6][#6][#6]1	PUBCHEM_877
PUBCHEM_878	[#17][#6]1[#6]([#17])[#6][#6][#6]1	PUBCHEM_878
PUBCHEM_879	[#17][#6]1[#6]([#35])[#6][#6][#6]1	PUBCHEM_879
PUBCHEM_880	[#35][#6]1[#6]([#35])[#6][#6][#6]1	PUBCHEM_880
TX_1_Phenol	c1ccc(cc1)O	Phenol
