0  B5R0.3  CNC(=O)CBr BBC/195 [0,0,0,0,0,0|3,0,0]=3
1  B4R0.1  CC(S)CS BBC/795 [1,0,0,0,0,0|0,2,1]=4
2  B4R0.1  C\C(N)=N/O BBC/503 [1,0,0,0,0,0|2,0,0]=3
3  B4R0.1  NCC(=O)[O-] BBC/598 [1,0,0,0,0,0|1,0,1]=3
4  B4R0.1  O=C(O)CO BBC/181 [1,0,0,0,0,0|0,0,0]=1
5  B6R0.1  CCCC(=O)NN BBC/636 [0,1,0,0,0,0|3,0,0]=4
6  B6R0.1  CCNC(=O)CBr BBB/922 [0,1,0,0,0,0|2,0,0]=3
7  B6R0.3  CN(C)C(=O)CBr BBC/075 [0,1,0,0,0,0|3,0,0]=4
8  B3R0.2  CC(=O)[O-] BBC/813 [2,0,0,0,0,0|0,0,1]=3
9  B3R0.2  O=C([O-])[O-] BBC/797 [2,0,0,0,0,0|0,0,2]=4
10  B5R0.1  CC(=O)NCO BBC/282 [1,1,0,0,0,0|0,0,0]=2
11  B5R0.1  O=C(O)CCBr BBC/178 [1,1,0,0,0,0|1,0,0]=3
12  B5R0.2  CC\C=C\CC BBC/270 [1,1,0,0,0,0|2,0,0]=4
13  B7R0.2  CC(C)NC(=O)CBr BBB/921 [0,2,0,0,0,0|2,0,0]=4
14  B7R0.3  C=CCNC(=O)CBr BBC/905 [0,2,0,0,0,0|2,0,0]=4
15  B7R0.3  CCOCC(=O)NN BBB/565 [0,2,0,0,0,0|2,0,0]=4
16  B7R0.3  CCOCC(=O)NN BBB/756 [0,2,0,0,0,0|2,0,0]=4
17  B7R0.3  COCC\C(N)=N/O BBC/016 [0,2,0,0,0,0|2,0,0]=4
18  B7R0.5  CCOC(=O)[C@H](C)O BBC/170 [0,2,0,0,0,0|1,0,0]=3
19  B7R0.7  CCOC(=O)CC#N BBC/167 [0,2,0,0,0,0|2,0,0]=4
20  B7R0.10  COC(C)C(=O)NN BBB/628 [0,2,0,0,0,0|2,0,0]=4
21  B7R0.12  COCC(CO)OC BBC/764 [0,2,0,0,0,0|0,0,2]=4
22  B7R0.18  NC(CO)(CO)CO BBC/191 [0,2,0,0,0,0|0,0,2]=4
23  B7R1.3  O=C1CNCCN1 BBB/413 [0,1,0,1,0,0|2,0,0]=4