0  B4R0.1  C=C[C@H](C)N N11431 [0,0,0,0,0,0|2,0,2]=4
1  B4R0.1  C[C@H](N)C#N 96735 [0,0,0,0,0,0|1,0,1]=2
2  B4R0.1  C[C@H](N)CF AC1331 [0,0,0,0,0,0|2,0,2]=4
3  B4R0.1  NC(=S)CF E70025 [0,0,0,0,0,0|2,1,1]=4
4  B5R0.1  C[C@H](N)CC#N 83614 [0,1,0,0,0,0|1,0,1]=3
5  B5R0.3  C#C[C@@H](N)CO F30988 [0,1,0,0,0,0|2,0,1]=4
6  B6R0.1  CC[C@H](N)CC#N Y13628 [0,2,0,0,0,0|1,0,1]=4
7  B6R0.1  N#CC[C@H](N)CO Y14487 [0,2,0,0,0,0|1,0,1]=4
8  B6R0.3  CC(C)C(=O)CN AT23528 [0,2,0,0,0,0|0,0,2]=4
9  B6R0.3  O=C(CBr)C(F)F AT12824 [0,2,0,0,0,0|1,0,1]=4
10  B6R0.4  CC(C)NCC#N 78909 [0,2,0,0,0,0|1,0,1]=4
11  B6R0.8  CC(C)(C#N)CBr AC8195 [0,2,0,0,0,0|1,0,1]=4
12  B6R0.9  C\C=C(\C=O)CC AC9866 [0,2,0,0,0,0|1,0,1]=4
13  B6R1.5  O=C1CC(F)C1 P13807 [0,1,0,1,0,0|1,0,1]=4
14  B6R1.8  N#CC1CC1N P20045 [0,1,0,1,0,0|1,0,1]=4
15  B6R1.4  N[C@H]1CNC1=O P11921 [0,1,0,1,0,0|0,0,2]=4
16  B6R1.6  N#CC1CCN1 AT24531 [0,1,0,1,0,0|1,0,1]=4