0  B4R0.1  CSC(=N)N c07933 [0,0,0,0,0,0|2,1,0]=3
1  B3R0.1  O=CC=O c08615 [1,0,0,0,0,0|2,0,0]=3
2  B3R0.2  N=C(N)N e00606 [1,0,0,0,0,0|3,0,0]=4
3  B3R0.2  N=C(N)N e00716 [1,0,0,0,0,0|3,0,0]=4
4  B5R0.1  CCOC(C)=N e00765 [0,1,0,0,0,0|1,0,0]=2
5  B5R0.1  CCOC(N)=O e00601 [0,1,0,0,0,0|1,0,0]=2
6  B5R0.1  O=C(O)CCCl c08426 [0,1,0,0,0,0|2,0,0]=3
7  B5R0.3  CNC(=O)CBr c03477 [0,1,0,0,0,0|1,0,0]=2
8  B5R0.3  COC(C)CN c04117 [0,1,0,0,0,0|1,0,1]=3
9  B5R0.5  CC(N)C(=O)O a05624 [0,1,0,0,0,0|2,0,0]=3
10  B5R0.5  CC(O)C(N)=O a02586 [0,1,0,0,0,0|2,0,0]=3
11  B4R0.3  NS(=O)(=O)O c08654 [1,1,0,0,0,0|2,0,0]=4
12  B6R0.1  CCCC(=O)NN c01412 [0,2,0,0,0,0|2,0,0]=4
13  B6R0.1  CCNC(=O)CBr c03466 [0,2,0,0,0,0|1,0,0]=3
14  B6R0.2  CC(=O)NC(N)=O e00904 [0,2,0,0,0,0|1,0,1]=4
15  B6R0.3  COC(C)C(N)=O c01805 [0,2,0,0,0,0|0,0,1]=3
16  B6R0.3  NC(CO)C(=O)O a05622 [0,2,0,0,0,0|2,0,0]=4
17  B6R0.3  NC(CS)C(=O)O a05621 [0,2,0,0,0,0|2,0,0]=4
18  B6R0.3  NC(CS)C(=O)O a05623 [0,2,0,0,0,0|2,0,0]=4
19  B6R0.3  N[C@@H](CS)C(=O)O e00655 [0,2,0,0,0,0|2,0,0]=4
20  B6R0.4  CNCCC(N)=O c07376 [0,2,0,0,0,0|2,0,0]=4
21  B6R0.4  NCCCC(=O)O e00886 [0,2,0,0,0,0|2,0,0]=4
22  B6R0.9  CCC(CN)OC c04119 [0,2,0,0,0,0|1,0,1]=4