0  B3R0.2  CC(=N)N A12781 [0,0,0,0,0,0|3,0,1]=4
1  B3R0.2  Cl[Rh](Cl)Cl R5389 [0,0,0,0,0,0|1,0,0]=1
2  B2R0.1  BrCBr D18889 [1,0,0,0,0,0|0,2,0]=3
3  B2R0.1  CNC M12422 [1,0,0,0,0,0|3,0,0]=4
4  B2R0.1  ICI D18884 [1,0,0,0,0,0|0,2,0]=3
5  B2R0.1  N#CBr C19016 [1,0,0,0,0,0|1,1,1]=4
6  B4R0.1  CC[C@@H](C)O B4806 [0,1,0,0,0,0|3,0,0]=4
7  B4R0.1  CC[C@H](C)O B4805 [0,1,0,0,0,0|3,0,0]=4
8  B4R0.1  C[C@@H](Cl)CO C4812 [0,1,0,0,0,0|2,0,0]=3
9  B4R0.1  C[C@@H](N)CN D1041 [0,1,0,0,0,0|3,0,0]=4
10  B4R0.1  C[C@@H](N)CN D7317 [0,1,0,0,0,0|3,0,0]=4
11  B4R0.1  C[C@@H](N)CO A1425 [0,1,0,0,0,0|3,0,0]=4
12  B4R0.1  C[C@@H](O)CCl C4810 [0,1,0,0,0,0|2,0,0]=3
13  B4R0.1  C[C@@H](O)CCl C4810 [0,1,0,0,0,0|2,0,0]=3
14  B4R0.1  C[C@@H](O)CN A6198 [0,1,0,0,0,0|3,0,0]=4
15  B4R0.1  C[C@@H](O)CN A6198 [0,1,0,0,0,0|3,0,0]=4
16  B4R0.1  C[C@@H](O)CO P2644 [0,1,0,0,0,0|3,0,0]=4
17  B4R0.1  C[C@@H](O)CO P2644 [0,1,0,0,0,0|3,0,0]=4
18  B4R0.1  C[C@H](Cl)CO C4811 [0,1,0,0,0,0|2,0,0]=3
19  B4R0.1  C[C@H](N)CO A5008 [0,1,0,0,0,0|3,0,0]=4
20  B4R0.1  C[C@H](N)CO A5008 [0,1,0,0,0,0|3,0,0]=4
21  B4R0.1  C[C@H](O)CCl C4809 [0,1,0,0,0,0|2,0,0]=3
22  B4R0.1  C[C@H](O)CCl C4809 [0,1,0,0,0,0|2,0,0]=3
23  B4R0.1  C[C@H](O)CN A5854 [0,1,0,0,0,0|3,0,0]=4
24  B4R0.1  C[C@H](O)CO P6701 [0,1,0,0,0,0|3,0,0]=4
25  B3R0.1  C#CCN P12530 [1,1,0,0,0,0|2,0,0]=4
26  B3R0.1  C#CCN P12531 [1,1,0,0,0,0|2,0,0]=4
27  B5R0.3  C=C(CCl)CCl C19303 [0,2,0,0,0,0|1,0,1]=4
28  B5R0.3  ClCC(Br)CBr D10531 [0,2,0,0,0,0|0,2,0]=4
29  B5R0.3  OC[C@@H](O)CCl C4763 [0,2,0,0,0,0|2,0,0]=4
30  B5R0.3  OC[C@@H](O)CCl C4763 [0,2,0,0,0,0|2,0,0]=4
31  B5R0.3  OC[C@H](O)CCl C4762 [0,2,0,0,0,0|2,0,0]=4
32  B5R0.3  OC[C@H](O)CCl C4762 [0,2,0,0,0,0|2,0,0]=4
33  B5R0.5  CC(Cl)C(=O)Cl C18873 [0,2,0,0,0,0|1,0,0]=3
34  B5R0.5  C[C@@H](Cl)C(=O)O C6128 [0,2,0,0,0,0|2,0,0]=4
35  B5R0.5  C[C@H](Cl)C(=O)O C4804 [0,2,0,0,0,0|2,0,0]=4
36  B5R0.5  O=C([O-])C(Cl)Cl S19114 [0,2,0,0,0,0|1,0,0]=3
37  B5R1.2  ClC1CCC1 C18781 [0,1,0,1,0,0|2,0,0]=4
38  B5R1.3  ClC[C@@H]1CO1 E4755 [0,1,0,1,0,0|2,0,0]=4
39  B5R1.3  ClC[C@@H]1CO1 E4755 [0,1,0,1,0,0|2,0,0]=4
40  B5R1.3  ClC[C@H]1CO1 E4754 [0,1,0,1,0,0|2,0,0]=4