0  B3R0.2  CC(=O)[O-] AC2626 [0,0,0,0,0,0|4,0,0]=4
1  B3R0.2  CC(=O)[O-] D70195 [0,0,0,0,0,0|4,0,0]=4
2  B3R0.2  CC(=O)[O-] I11566 [0,0,0,0,0,0|4,0,0]=4
3  B3R0.2  CC(Br)Br D78418 [0,0,0,0,0,0|2,2,0]=4
4  B3R0.2  C[13C](=O)O 41422 [0,0,0,0,0,0|4,0,0]=4
5  B3R0.2  C[S+](C)C AC2631 [0,0,0,0,0,0|4,0,0]=4
6  B3R0.2  O=C([O-])[O-] AC2639 [0,0,0,0,0,0|4,0,0]=4
7  B3R0.2  O=C([O-])[O-] AC7869 [0,0,0,0,0,0|4,0,0]=4
8  B3R0.2  O=C([O-])[O-] F20746 [0,0,0,0,0,0|4,0,0]=4
9  B3R0.2  [13CH3]C(=O)O 41421 [0,0,0,0,0,0|4,0,0]=4
10  B3R0.2  [15NH2]C([15NH2])=O 41394 [0,0,0,0,0,0|4,0,0]=4
11  B3R0.2  [15NH2][13C]([15NH2])=O 41395 [0,0,0,0,0,0|4,0,0]=4
12  B2R0.1  CNC T70981 [1,0,0,0,0,0|3,0,0]=4
13  B2R0.1  CNN C10129 [1,0,0,0,0,0|3,0,0]=4
14  B2R0.1  CSC D78287 [1,0,0,0,0,0|3,0,0]=4
15  B2R0.1  FCI AT16478 [1,0,0,0,0,0|1,2,0]=4
16  B2R0.1  N#C[S-] F21288 [1,0,0,0,0,0|3,0,0]=4
17  B4R0.1  C[C@H](Cl)CN Y14715 [0,1,0,0,0,0|3,0,0]=4
18  B4R0.3  Cl[Pd-2](Cl)(Cl)Cl AC2661 [0,1,0,0,0,0|1,0,0]=2
19  B4R0.3  Cl[Pt-2](Cl)(Cl)Cl 23131 [0,1,0,0,0,0|1,0,0]=2
20  B1R0.1  C=C D89533 [2,0,0,0,0,0|2,0,0]=4
21  B1R0.1  C=C F16606 [2,0,0,0,0,0|2,0,0]=4
22  B1R0.1  [C-]#[O+] T71827 [2,0,0,0,0,0|2,0,0]=4
23  B1R0.1  [CH]=C D78465 [2,0,0,0,0,0|2,0,0]=4
24  B3R0.1  ClCCI T71139 [1,1,0,0,0,0|1,1,0]=4
25  B5R0.4  CC(C)(Cl)CCl H11156 [0,2,0,0,0,0|2,0,0]=4