0  B3R0.1  C#CCN P12530 [0,0,0,0,0,0|2,0,2]=4
1  B3R0.1  C#CCN P12531 [0,0,0,0,0,0|2,0,2]=4
2  B2R0.1  BrCBr D18889 [1,0,0,0,0,0|2,0,1]=4
3  B2R0.1  CNC M12422 [1,0,0,0,0,0|0,0,2]=3
4  B2R0.1  ICI D18884 [1,0,0,0,0,0|2,0,1]=4
5  B2R0.1  N#CBr C19016 [1,0,0,0,0,0|1,0,2]=4
6  B4R0.1  CC(=O)NO A3293 [0,1,0,0,0,0|2,1,0]=4
7  B4R0.1  CC(N)=NN A13105 [0,1,0,0,0,0|2,0,1]=4
8  B4R0.1  CCC(=N)N P12993 [0,1,0,0,0,0|2,0,1]=4
9  B4R0.1  CC[C@@H](C)O B4806 [0,1,0,0,0,0|1,1,1]=4
10  B4R0.1  CC[C@H](C)O B4805 [0,1,0,0,0,0|1,1,1]=4
11  B4R0.1  CSC(=N)N M13864 [0,1,0,0,0,0|2,0,1]=4
12  B4R0.1  C[C@@H](Cl)CO C4812 [0,1,0,0,0,0|1,1,1]=4
13  B4R0.1  C[C@@H](N)CN D1041 [0,1,0,0,0,0|2,0,1]=4
14  B4R0.1  C[C@@H](N)CN D7317 [0,1,0,0,0,0|2,0,1]=4
15  B4R0.1  C[C@@H](N)CO A1425 [0,1,0,0,0,0|1,1,1]=4
16  B4R0.1  C[C@@H](O)CCl C4810 [0,1,0,0,0,0|2,0,1]=4
17  B4R0.1  C[C@@H](O)CCl C4810 [0,1,0,0,0,0|2,0,1]=4
18  B4R0.1  C[C@@H](O)CN A6198 [0,1,0,0,0,0|2,0,1]=4
19  B4R0.1  C[C@@H](O)CN A6198 [0,1,0,0,0,0|2,0,1]=4
20  B4R0.1  C[C@@H](O)CO P2644 [0,1,0,0,0,0|1,1,1]=4
21  B4R0.1  C[C@@H](O)CO P2644 [0,1,0,0,0,0|1,1,1]=4
22  B4R0.1  C[C@H](Cl)CO C4811 [0,1,0,0,0,0|1,1,1]=4
23  B4R0.1  C[C@H](N)CO A5008 [0,1,0,0,0,0|1,1,1]=4
24  B4R0.1  C[C@H](N)CO A5008 [0,1,0,0,0,0|1,1,1]=4
25  B4R0.1  C[C@H](O)CCl C4809 [0,1,0,0,0,0|2,0,1]=4
26  B4R0.1  C[C@H](O)CCl C4809 [0,1,0,0,0,0|2,0,1]=4
27  B4R0.1  C[C@H](O)CN A5854 [0,1,0,0,0,0|2,0,1]=4
28  B4R0.1  C[C@H](O)CO P6701 [0,1,0,0,0,0|1,1,1]=4
29  B4R0.1  C\C(N)=N\O H13104 [0,1,0,0,0,0|2,0,1]=4
30  B4R0.2  BrCCCBr D18864 [0,1,0,0,0,0|2,0,1]=4
31  B4R0.2  NCCCCl C18780 [0,1,0,0,0,0|2,0,1]=4
32  B4R0.2  NCCCO A18882 [0,1,0,0,0,0|1,1,1]=4
33  B4R0.2  NNCCO H13045 [0,1,0,0,0,0|3,0,0]=4
34  B3R0.2  CC(=N)N A12781 [1,1,0,0,0,0|1,0,1]=4