5 5 [CX4]
0 0 [$([CX2](=C)=C)] 
6 6 [$([CX3]=[CX3])] 
2 2 [$([CX2]#C)]
1 1 [CX3]=[OX1] 
1 1 [$([CX3]=[OX1]),$([CX3+]-[OX1-])] 
0 0 [CX3](=[OX1])C 
1 1 [OX1]=CN 
1 1 [CX3](=[OX1])O 
0 0 [CX3](=[OX1])[F,Cl,Br,I] 
0 0 [CX3H1](=O)[#6] 
0 0 [CX3](=[OX1])[OX2][CX3](=[OX1]) 
0 0 [NX3][CX3](=[OX1])[#6] 
0 0 [NX3][CX3]=[NX3+] 
1 1 [NX3,NX4+][CX3](=[OX1])[OX2,OX1-] 
1 1 [NX3][CX3](=[OX1])[OX2H0] 
0 0 [NX3,NX4+][CX3](=[OX1])[OX2H,OX1-] 
0 0 [CX3](=O)[O-] 
0 0 [CX3](=[OX1])(O)O 
0 0 [CX3](=[OX1])([OX2])[OX2H,OX1H0-1] 
0 0 [CX3](=O)[OX2H1] 
0 0 [CX3](=O)[OX1H0-,OX2H1] 
0 0 [NX3][CX2]#[NX1] 
0 0 [#6][CX3](=O)[OX2H0][#6] 
0 0 [#6][CX3](=O)[#6] 
1 1 [OD2]([#6])[#6]
5 5 [H] 
21 21 [!#1] 
0 0 [H+] 
0 0 [+H] 
25 25 [!H]
25 25 [!H1] 
0 0 [NX3;H2,H1;!$(NC=O)] 
1 1 [NX3][CX3]=[CX3] 
0 0 [NX3;H2;!$(NC=[!#6]);!$(NC#[!#6])][#6]
0 0 [NX3;H2,H1;!$(NC=O)].[NX3;H2,H1;!$(NC=O)] 
1 1 [NX3][$(C=C),$(cc)]
0 0 [NX3,NX4+][CX4H]([*])[CX3](=[OX1])[O,N] 
0 0 [NX3H2,NH3X4+][CX4H]([*])[CX3](=[OX1])[NX3,NX4+][CX4H]([*])[CX3](=[OX1])[OX2H,OX1-] 
0 0 [$([NX3H2,NX4H3+]),$([NX3H](C)(C))][CX4H]([*])[CX3](=[OX1])[OX2H,OX1-,N] 
0 0 [CH3X4] 
0 0 [CH2X4][CH2X4][CH2X4][NHX3][CH0X3](=[NH2X3+,NHX2+0])[NH2X3] 
0 0 [CH2X4][CX3](=[OX1])[NX3H2] 
0 0 [CH2X4][CX3](=[OX1])[OH0-,OH] 
0 0 [CH2X4][SX2H,SX1H0-] 
0 0 [CH2X4][CH2X4][CX3](=[OX1])[OH0-,OH] 
0 0 [$([$([NX3H2,NX4H3+]),$([NX3H](C)(C))][CX4H2][CX3](=[OX1])[OX2H,OX1-,N])] 
0 0 [CH2X4][#6X3]1:[$([#7X3H+,#7X2H0+0]:[#6X3H]:[#7X3H]),$([#7X3H])]:[#6X3H]:[$([#7X3H+,#7X2H0+0]:[#6X3H]:[#7X3H]),$([#7X3H])]:[#6X3H]1 
0 0 [CHX4]([CH3X4])[CH2X4][CH3X4] 
0 0 [CH2X4][CHX4]([CH3X4])[CH3X4] 
0 0 [CH2X4][CH2X4][CH2X4][CH2X4][NX4+,NX3+0] 
0 0 [CH2X4][CH2X4][SX2][CH3X4] 
0 0 [CH2X4][cX3]1[cX3H][cX3H][cX3H][cX3H][cX3H]1 
0 0 [$([NX3H,NX4H2+]),$([NX3](C)(C)(C))]1[CX4H]([CH2][CH2][CH2]1)[CX3](=[OX1])[OX2H,OX1-,N] 
0 0 [CH2X4][OX2H] 
0 0 [NX3][CX3]=[SX1] 
0 0 [CHX4]([CH3X4])[OX2H] 
0 0 [CH2X4][cX3]1[cX3H][nX3H][cX3]2[cX3H][cX3H][cX3H][cX3H][cX3]12 
0 0 [CH2X4][cX3]1[cX3H][cX3H][cX3]([OHX2,OH0X1-])[cX3H][cX3H]1 
0 0 [CHX4]([CH3X4])[CH3X4] 
0 0 [CH3X4] 
0 0 [CH2X4][CH2X4][CH2X4][NHX3][CH0X3](=[NH2X3+,NHX2+0])[NH2X3] 
0 0 [CH2X4][CX3](=[OX1])[NX3H2] 
0 0 [CH2X4][CX3](=[OX1])[OH0-,OH] 
0 0 [CH2X4][SX2H,SX1H0-] 
0 0 [CH2X4][CH2X4][CX3](=[OX1])[OH0-,OH] 
0 0 [CH2X4][#6X3]1:[$([#7X3H+,#7X2H0+0]:[#6X3H]:[#7X3H]),$([#7X3H])]:[#6X3H]:[$([#7X3H+,#7X2H0+0]:[#6X3H]:[#7X3H]),$([#7X3H])]:[#6X3H]1 
0 0 [CHX4]([CH3X4])[CH2X4][CH3X4] 
0 0 [CH2X4][CHX4]([CH3X4])[CH3X4] 
0 0 [CH2X4][CH2X4][CH2X4][CH2X4][NX4+,NX3+0] 
0 0 [CH2X4][CH2X4][SX2][CH3X4] 
0 0 [CH2X4][cX3]1[cX3H][cX3H][cX3H][cX3H][cX3H]1 
0 0 [CH2X4][OX2H] 
0 0 [CHX4]([CH3X4])[OX2H] 
0 0 [CH2X4][cX3]1[cX3H][nX3H][cX3]2[cX3H][cX3H][cX3H][cX3H][cX3]12 
0 0 [CH2X4][cX3]1[cX3H][cX3H][cX3]([OHX2,OH0X1-])[cX3H][cX3H]1 
0 0 [CHX4]([CH3X4])[CH3X4]
0 0 [$(*-[NX2-]-[NX2+]#[NX1]),$(*-[NX2]=[NX2+]=[NX1-])] 
0 0 [$([NX1-]=[NX2+]=[NX1-]),$([NX1]#[NX2+]-[NX1-2])] 
1 1 [#7] 
0 0 [NX2]=N 
0 0 [NX2]=[NX2] 
0 0 [$([NX2]=[NX3+]([O-])[#6]),$([NX2]=[NX3+0](=[O])[#6])] 
0 0 [$([#6]=[N+]=[N-]),$([#6-]-[N+]#[N])] 
0 0 [$([nr5]:[nr5,or5,sr5]),$([nr5]:[cr5]:[nr5,or5,sr5])] 
0 0 [NX3][NX3]
0 0 [NX3][NX2]=[*]
0 0 [CX3;$([C]([#6])[#6]),$([CH][#6])]=[NX2][#6] 
0 0 [$([CX3]([#6])[#6]),$([CX3H][#6])]=[$([NX2][#6]),$([NX2H])] 
0 0 [NX3+]=[CX3]
0 0 [CX3](=[OX1])[NX3H][CX3](=[OX1]) 
0 0 [CX3](=[OX1])[NX3H0]([#6])[CX3](=[OX1]) 
0 0 [CX3](=[OX1])[NX3H0]([NX3H0]([CX3](=[OX1]))[CX3](=[OX1]))[CX3](=[OX1])
0 0 [$([NX3](=[OX1])(=[OX1])O),$([NX3+]([OX1-])(=[OX1])O)] 
0 0 [$([OX1]=[NX3](=[OX1])[OX1-]),$([OX1]=[NX3+]([OX1-])[OX1-])]
0 0 [NX1]#[CX2] 
0 0 [CX1-]#[NX2+]
0 0 [$([NX3](=O)=O),$([NX3+](=O)[O-])][!#8]
0 0 [$([NX3](=O)=O),$([NX3+](=O)[O-])][!#8].[$([NX3](=O)=O),$([NX3+](=O)[O-])][!#8]
0 0 [NX2]=[OX1]
0 0 [$([#7+][OX1-]),$([#7v5]=[OX1]);!$([#7](~[O])~[O]);!$([#7]=[#7])] 
0 0 [OX2H] 
0 0 [#6][OX2H] 
0 0 [OX2H][CX3]=[OX1] 
0 0 [OX2H]P 
0 0 [OX2H][#6X3]=[#6] 
0 0 [OX2H][cX3]:[c] 
0 0 [OX2H][$(C=C),$(cc)] 
0 0 [$([OH]-*=[!#6])] 
0 0 [OX2,OX1-][OX2,OX1-] 
0 0 [$(P(=[OX1])([$([OX2H]),$([OX1-]),$([OX2]P)])([$([OX2H]),$([OX1-]),$([OX2]P)])[$([OX2H]),$([OX1-]),$([OX2]P)]),$([P+]([OX1-])([$([OX2H]),$([OX1-]),$([OX2]P)])([$([OX2H]),$([OX1-]),$([OX2]P)])[$([OX2H]),$([OX1-]),$([OX2]P)])] 
0 0 [$(P(=[OX1])([OX2][#6])([$([OX2H]),$([OX1-]),$([OX2][#6])])[$([OX2H]),$([OX1-]),$([OX2][#6]),$([OX2]P)]),$([P+]([OX1-])([OX2][#6])([$([OX2H]),$([OX1-]),$([OX2][#6])])[$([OX2H]),$([OX1-]),$([OX2][#6]),$([OX2]P)])] 
0 0 [S-][CX3](=S)[#6] 
0 0 [#6X3](=[SX1])([!N])[!N] 
0 0 [SX2] 
0 0 [#16X2H] 
0 0 [#16!H0] 
0 0 [NX3][CX3]=[SX1]
0 0 [#16X2H0] 
0 0 [#16X2H0][!#16] 
0 0 [#16X2H0][#16X2H0] 
0 0 [#16X2H0][!#16].[#16X2H0][!#16] 
0 0 [$([#16X3](=[OX1])[OX2H0]),$([#16X3+]([OX1-])[OX2H0])] 
0 0 [$([#16X3](=[OX1])[OX2H,OX1H0-]),$([#16X3+]([OX1-])[OX2H,OX1H0-])] 
0 0 [$([#16X4](=[OX1])=[OX1]),$([#16X4+2]([OX1-])[OX1-])] 
0 0 [$([#16X4](=[OX1])(=[OX1])([#6])[#6]),$([#16X4+2]([OX1-])([OX1-])([#6])[#6])] 
0 0 [$([#16X4](=[OX1])(=[OX1])([#6])[OX2H,OX1H0-]),$([#16X4+2]([OX1-])([OX1-])([#6])[OX2H,OX1H0-])] 
0 0 [$([#16X4](=[OX1])(=[OX1])([#6])[OX2H0]),$([#16X4+2]([OX1-])([OX1-])([#6])[OX2H0])] 
0 0 [$([#16X4]([NX3])(=[OX1])(=[OX1])[#6]),$([#16X4+2]([NX3])([OX1-])([OX1-])[#6])] 
0 0 [SX4](C)(C)(=O)=N 
0 0 [$([SX4](=[OX1])(=[OX1])([!O])[NX3]),$([SX4+2]([OX1-])([OX1-])([!O])[NX3])] 
0 0 [$([#16X3]=[OX1]),$([#16X3+][OX1-])] 
0 0 [$([#16X3](=[OX1])([#6])[#6]),$([#16X3+]([OX1-])([#6])[#6])] 
0 0 [$([#16X4](=[OX1])(=[OX1])([OX2H,OX1H0-])[OX2][#6]),$([#16X4+2]([OX1-])([OX1-])([OX2H,OX1H0-])[OX2][#6])] 
0 0 [$([SX4](=O)(=O)(O)O),$([SX4+2]([O-])([O-])(O)O)] 
0 0 [$([#16X4](=[OX1])(=[OX1])([OX2][#6])[OX2][#6]),$([#16X4](=[OX1])(=[OX1])([OX2][#6])[OX2][#6])] 
0 0 [$([#16X4]([NX3])(=[OX1])(=[OX1])[OX2][#6]),$([#16X4+2]([NX3])([OX1-])([OX1-])[OX2][#6])] 
0 0 [$([#16X4]([NX3])(=[OX1])(=[OX1])[OX2H,OX1H0-]),$([#16X4+2]([NX3])([OX1-])([OX1-])[OX2H,OX1H0-])] 
0 0 [#16X2][OX2H,OX1H0-] 
0 0 [#16X2][OX2H0]
4 4 [#6][F,Cl,Br,I] 
4 4 [F,Cl,Br,I] 
0 5 [F,Cl,Br,I].[F,Cl,Br,I].[F,Cl,Br,I] 
0 0 [CX3](=[OX1])[F,Cl,Br,I] 
0 0 [$([#6X4@](*)(*)(*)*),$([#6X4@H](*)(*)*)] 
0 0 [$([cX2+](:*):*)] 
0 0 [$([cX3](:*):*),$([cX2+](:*):*)] 
7 7 [$([cX3](:*):*),$([cX2+](:*):*),$([CX3]=*),$([CX2+]=*)] 
0 0 [$([nX3](:*):*),$([nX2](:*):*),$([#7X2]=*),$([NX3](=*)=*),$([#7X3+](-*)=*),$([#7X3+H]=*)] 
0 0 [$([#1X1][$([nX3](:*):*),$([nX2](:*):*),$([#7X2]=*),$([NX3](=*)=*),$([#7X3+](-*)=*),$([#7X3+H]=*)])] 
1 1 [$([NX4+]),$([NX3]);!$(*=*)&!$(*:*)] 
0 0 [$([$([NX3]=O),$([NX3+][O-])])] 
0 0 [$([$([NX4]=O),$([NX4+][O-])])] 
0 0 [$([$([NX4]=O),$([NX4+][O-,#0])])] 
0 0 [$([NX4+]),$([NX4]=*)] 
0 0 [$([SX3]=N)] 
0 0 [$([SX1]=[#6])] 
0 0 [$([NX1]#*)] 
1 1 [$([OX2])]
0 0 [R0;D2][R0;D2][R0;D2][R0;D2] 
0 0 [R0;D2]~[R0;D2]~[R0;D2]~[R0;D2] 
0 0 [AR0]~[AR0]~[AR0]~[AR0]~[AR0]~[AR0]~[AR0]~[AR0] 
0 0 [$([SX1]~P)] 
0 0 [$([NX3]C=N)] 
0 0 [$([NX3]N=C)] 
0 0 [$([NX3]N=N)] 
0 0 [$([OX2]C=N)] 
0 0 [R2][R2] 
17 17 [R0]
17 17 [!R] 
0 0 [r;!r3;!r4;!r5;!r6;!r7] 
0 0 [sX2r5] 
0 0 [oX2r5] 
0 0 [nX2r5] 
0 0 [X4;R2;r4,r5,r6](@[r4,r5,r6])(@[r4,r5,r6])(@[r4,r5,r6])@[r4,r5,r6]
0 0 [$([nX2r5]:[a-]),$([nX2r5]:[a]:[a-])]
0 0 [cR1]1[cR1][cR1][cR1][cR1][cR1]1 
0 0 [cR1]1[cR1][cR1][cR1][cR1][cR1]1.[cR1]1[cR1][cR1][cR1][cR1][cR1]1 
0 0 [NX3,NX4+][CX4H]([*])[CX3](=[OX1])[O,N] 
0 0 [$([$([NX3H,NX4H2+]),$([NX3](C)(C)(C))]1[CX4H]([CH2][CH2][CH2]1)[CX3](=[OX1])[OX2H,OX1-,N]),$([$([NX3H2,NX4H3+]),$([NX3H](C)(C))][CX4H2][CX3](=[OX1])[OX2H,OX1-,N]),$([$([NX3H2,NX4H3+]),$([NX3H](C)(C))][CX4H]([*])[CX3](=[OX1])[OX2H,OX1-,N])] 
0 0 [$([NX3H,NX4H2+]),$([NX3](C)(C)(C))]1[CX4H]([CH2][CH2][CH2]1)[CX3](=[OX1])[OX2H,OX1-,N] 
0 0 [$([$([NX3H2,NX4H3+]),$([NX3H](C)(C))][CX4H2][CX3](=[OX1])[OX2H,OX1-,N])] 
0 0 [$([NX3H2,NX4H3+]),$([NX3H](C)(C))][CX4H]([*])[CX3](=[OX1])[OX2H,OX1-,N] 
0 0 [#16X2H0] 
0 0 [#16X2H0][!#16] 
0 0 [#16X2H0][#16X2H0] 
0 0 [#16X2H0][!#16].[#16X2H0][!#16] 
0 0 [OX2H,OX1H0-] 
1 1 [OX2H0] 
5 5 [H1,H0-] 
0 0 [NX3;H2,H1;!$(NC=O)].[NX3;H2,H1;!$(NC=O)] 
14 14 [#6]
14 14 [c,C] 
0 0 [#0] 
0 0 [OX2,OX1-][OX2,OX1-]
0 0 [O;X2,X1-][O;X2,X1-] 
1 1 [N&X4&+,N&X3&+0]
1 1 [NX4+,NX3+0] 
16 16 [*!H0,#1] 
15 15 [#6!H0,#1] 
14 14 [H,#1] 
0 0 [!H0;F,Cl,Br,I,N+,$([OH]-*=[!#6]),+] 
0 0 [CX3](=O)[OX2H1] 
0 0 [CX3](=O)[OX1H0-,OX2H1] 
0 0 [$([OH]-*=[!#6])] 
0 0 [$(P(=[OX1])([$([OX2H]),$([OX1-]),$([OX2]P)])([$([OX2H]),$([OX1-]),$([OX2]P)])[$([OX2H]),$([OX1-]),$([OX2]P)]),$([P+]([OX1-])([$([OX2H]),$([OX1-]),$([OX2]P)])([$([OX2H]),$([OX1-]),$([OX2]P)])[$([OX2H]),$([OX1-]),$([OX2]P)])] 
0 0 [$([#16X4](=[OX1])(=[OX1])([#6])[OX2H,OX1H0-]),$([#16X4+2]([OX1-])([OX1-])([#6])[OX2H,OX1H0-])] 
0 0 [CX3](=[OX1])[F,Cl,Br,I] 
0 0 [NX2-] 
0 0 [OX2H+]=* 
0 0 [OX3H2+] 
0 0 [#6+] 
0 0 [$([cX2+](:*):*)] 
0 0 [$([NX1-]=[NX2+]=[NX1-]),$([NX1]#[NX2+]-[NX1-2])] 
0 0 [+1]~*~*~[-1] 
0 0 [#6,#7;R0]=[#8] 
1 1 [!$([#6,H0,-,-2,-3])] 
1 1 [!H0;#7,#8,#9] 
0 0 [O,N;!H0]-*~*-*=[$([C,N;R0]=O)] 
0 0 [#6;X3v3+0] 
0 0 [#7;X2v4+0] 
0 0 [#8]=[C,N]-aaa[F,Cl,Br,I] 
0 0 [O,N;!H0;R0] 
1 1 [#8]=[C,N]
1 1 O=[C,N] 
0 0 [$(c:cCl),$(c:c:cCl),$(c:c:c:cCl)]-[$(c:cCl),$(c:c:cCl),$(c:c:c:cCl)] 
0 0 [nX3r5+]:c:n 
0 0 Cc1:c(O):c:c:[$(cCl),$([cH])]:c1 
0 0 [!#1;!#2;!#3;!#5;!#6;!#7;!#8;!#9;!#11;!#12;!#15;!#16;!#17;!#19;!#20;!#35;!#53]
0 0 cc
0 0 c:c
0 0 c-c
2 2 O
0 0 [O;H1]
1 1 [O;D1]
1 1 [O;D2]
14 14 [C,c]
4 4 [F,Cl,Br,I]
1 1 [N;R]
2 2 [!C;R]
0 0 [n;H1] 
0 0 [n&H1] 
0 0 [c,n&H1] 
0 0 [c,n;H1]  
4 4 [C,c]=,#[C,c]
23 15 [$(*C);$(*CC)]
