0  B4R0.1  CC(=O)C=O T19536 [0,0,0,0,0,0|3,0,0]=3
1  B4R0.1  CC(=O)NO T1592 [0,0,0,0,0,0|2,1,1]=4
2  B4R0.1  CC(N)C=O T29820 [0,0,0,0,0,0|4,0,0]=4
3  B4R0.1  COC(N)=O T2151 [0,0,0,0,0,0|4,0,0]=4
4  B4R0.1  NC(=O)CI T8897 [0,0,0,0,0,0|4,0,0]=4
5  B4R0.1  NC(=O)NO T0676 [0,0,0,0,0,0|2,1,1]=4
6  B4R0.1  NCC(N)=O T3127 [0,0,0,0,0,0|4,0,0]=4
7  B4R0.1  NCC(O)=O T2O2728 [0,0,0,0,0,0|3,0,1]=4
8  B4R0.1  NCC([O-])=O T4505 [0,0,0,0,0,0|3,0,1]=4
9  B4R0.1  NCC([O-])=O T4512 [0,0,0,0,0,0|3,0,1]=4
10  B4R0.1  NNC(N)=O T1732 [0,0,0,0,0,0|3,1,0]=4
11  B4R0.1  OC(=O)C=O T16356 [0,0,0,0,0,0|2,0,1]=3
12  B4R0.1  OC(=O)C=O T4843 [0,0,0,0,0,0|2,0,1]=3
13  B4R0.1  OCC(O)=O T5985 [0,0,0,0,0,0|2,0,2]=4
14  B4R0.1  [O-]C(=O)CS T8530 [0,0,0,0,0,0|2,1,1]=4
15  B4R0.1  [O-]CC([O-])=O T2410 [0,0,0,0,0,0|2,0,2]=4
16  B3R0.2  CC([O-])=O T23377 [1,0,0,0,0,0|2,0,1]=4
17  B3R0.2  CC([O-])=O T35375 [1,0,0,0,0,0|2,0,1]=4
18  B3R0.2  CC([O-])=O T8129 [1,0,0,0,0,0|2,0,1]=4
19  B3R0.2  CC([S-])=O T22402 [1,0,0,0,0,0|2,1,0]=4
20  B3R0.2  NC(N)=O T0738 [1,0,0,0,0,0|2,1,0]=4
21  B3R0.2  NC(N)=O T20188 [1,0,0,0,0,0|2,1,0]=4
22  B3R0.2  [O-][SiH]([O-])=O T19904 [1,0,0,0,0,0|1,0,2]=4
23  B5R0.4  [O-]S(=O)(=O)CI T33322 [0,1,0,0,0,0|3,0,0]=4
24  B5R0.5  CC(=O)C(O)=O T4804 [0,1,0,0,0,0|2,0,1]=4
25  B5R0.5  CC(=O)C([O-])=O T7717 [0,1,0,0,0,0|2,0,1]=4
26  B5R0.5  NC(=O)C([O-])=O T19831 [0,1,0,0,0,0|2,0,1]=4
27  B5R0.5  OC(=O)C(O)=O T2O2680 [0,1,0,0,0,0|2,0,1]=4
28  B5R0.5  OC(=O)C(O)=O T5064 [0,1,0,0,0,0|2,0,1]=4
29  B2R0.1  NC=O T4767 [2,0,0,0,0,0|1,1,0]=4
30  B2R0.1  O=[Si]=O T1397 [2,0,0,0,0,0|1,0,0]=3
31  B2R0.1  O=[Si]=O T34642 [2,0,0,0,0,0|1,0,0]=3
32  B2R0.1  [O-]C=O T5300 [2,0,0,0,0,0|1,0,1]=4
33  B4R0.2  O=[Bi]O[Bi]=O T20946 [1,1,0,0,0,0|2,0,0]=4
34  B4R0.3  CS(C)(=O)=O TN6752 [1,1,0,0,0,0|2,0,0]=4
35  B4R0.3  NS(N)(=O)=O T35357 [1,1,0,0,0,0|1,1,0]=4
36  B4R0.3  [O-]S([O-])(=O)=O T19608 [1,1,0,0,0,0|1,0,1]=4
37  B4R0.3  [O-]S([O-])(=O)=O T20627 [1,1,0,0,0,0|1,0,1]=4
38  B4R0.3  [O-]S([O-])(=O)=O T29885 [1,1,0,0,0,0|1,0,1]=4