0  B12R1.489  CC1=NC=C(N1CCCl)[N+](=O)[O-] Z56938014 [0,0,0,0,0,0|1,0,0]=1
1  B12R1.489  CC1=NC=C(N1CCN)[N+](=O)[O-] Z5483450682 [0,0,0,0,0,0|1,0,0]=1
2  B12R1.489  CC1=NC=C(N1CCO)[N+](=O)[O-] Z87001124 [0,0,0,0,0,0|0,0,0]=0
3  B13R1.3386  CC#CCN1C(=CN=C1C)[N+](=O)[O-] Z1258863193 [0,1,0,0,0,0|1,0,1]=3
4  B13R1.3386  CCSCN1C(=CN=C1C)[N+](=O)[O-] Z2217461627 [0,1,0,0,0,0|1,0,0]=2
5  B13R1.3386  CSCCN1C(=CN=C1C)[N+](=O)[O-] Z1583341017 [0,1,0,0,0,0|0,1,0]=2
6  B13R1.3496  C=C(Br)CN1C(=CN=C1C)[N+](=O)[O-] Z1116584798 [0,1,0,0,0,0|1,0,1]=3
7  B13R1.3496  CC1=NC=C(N1CC(=O)O)[N+](=O)[O-] Z111458142 [0,1,0,0,0,0|0,0,1]=2
8  B13R1.3496  CC1=NC=C(N1CC(C)O)[N+](=O)[O-] Z1198155412 [0,1,0,0,0,0|0,0,0]=1
9  B13R2.72  O=C(O)C1=CN=C2N1CCOC2 Z2582231587 [0,0,0,1,0,0|1,0,1]=3
10  B13R1.354  O=C1C=CC(=CN1CCO)[N+](=O)[O-] Z335678798 [0,0,0,0,0,1|2,0,0]=3
11  B10R1.194  CC1=C(C=NN1C)[N+](=O)[O-] Z57683793 [2,0,0,0,0,0|2,0,0]=4
12  B10R1.194  CC1=NC=C(N1C)C(=O)O Z2489383855 [2,0,0,0,0,0|1,0,1]=4
13  B10R1.194  CC1=NC=C(N1C)[N+](=O)[O-] Z104493616 [2,0,0,0,0,0|0,0,0]=2
14  B10R1.257  CCN1C(=CN=C1C)CN Z2310728090 [2,0,0,0,0,0|2,0,0]=4
15  B10R1.5  CCCN1C=NC=C1C=O Z1255385085 [2,0,0,0,0,0|2,0,0]=4
16  B10R1.187  O=C1C=CC(=O)N1CCO Z763781306 [2,0,0,0,0,0|2,0,0]=4
17  B14R1.7480  O=[N+]([O-])C1=C(C(=CN=C1)Br)NCCO Z1554538079 [0,1,0,0,0,1|2,0,0]=4
18  B14R1.10175  CC1=NC=C(N1CC(O)CCl)[N+](=O)[O-] Z1269240018 [0,2,0,0,0,0|0,0,0]=2
19  B12R2.196  CC1=NC=C2N1CCNC2=O Z1618133391 [1,0,0,1,0,0|2,0,0]=4
20  B12R2.1362  O=C(O)C1=CN=C2N1CCC2 Z2488961462 [1,0,0,1,0,0|1,0,1]=4
21  B12R2.1  NCC1=CN=C2N1CCOC2 Z2895158960 [1,0,0,1,0,0|2,0,0]=4
22  B12R2.1  O=CC1=CN=C2N1CCOC2 Z1216843746 [1,0,0,1,0,0|1,0,0]=3
23  B12R2.1  OCC1=CN=C2N1CCOC2 Z2491074568 [1,0,0,1,0,0|1,0,1]=4
24  B14R2.2  O=C(O)CC1=CN=C2N1CCOC2 Z4913033047 [0,0,0,1,0,1|1,0,1]=4
25  B12R1.279  O=[N+]([O-])C1=CC=CC(=C1)CCO Z1250886952 [1,0,0,0,0,1|2,0,0]=4
26  B12R1.274  CC1=CC(=NN1CCO)C(=O)N Z1255448517 [0,0,0,0,1,1|2,0,0]=4