0  B5R0.1  CCSC(=N)N AE-641/00560030 [0,0,0,0,0,0|2,0,0]=2
1  B5R0.1  C\C(N)=C/C=O AJ-333/25022116 [0,0,0,0,0,0|2,0,2]=4
2  B4R0.1  NCC(=O)O AB-131/40217813 [1,0,0,0,0,0|2,0,0]=3
3  B6R0.1  CCNC(=O)CN AS-787/43399854 [0,1,0,0,0,0|1,0,0]=2
4  B6R0.1  CNCC(=O)OC AO-181/25113008 [0,1,0,0,0,0|2,0,0]=3
5  B6R0.1  N#CCC(=O)NN AC-907/25014397 [0,1,0,0,0,0|1,0,1]=3
6  B6R0.2  CC(C)=CC(=O)O AE-848/32066036 [0,1,0,0,0,0|1,0,2]=4
7  B6R0.2  NC(=O)C[N+](=O)[O-] AG-205/25011020 [0,1,0,0,0,0|2,0,0]=3
8  B6R0.4  O=CNCC(=O)O AH-034/32838045 [0,1,0,0,0,0|2,0,1]=4
9  B6R1.2  O=C1NC=CN1 AK-564/25068002 [0,0,0,1,0,0|1,0,2]=4
10  B5R0.3  CS\C(N)=N/N AG-205/01777002 [1,1,0,0,0,0|2,0,0]=4
11  B7R0.3  CCSCC(=O)NN AE-641/40262190 [0,2,0,0,0,0|0,0,0]=2
12  B7R0.5  CNCC(=O)N(C)C AS-787/43399850 [0,2,0,0,0,0|1,0,0]=3
13  B7R0.5  CSCC(N)C(=O)O AO-800/41069568 [0,2,0,0,0,0|1,0,0]=3
14  B7R0.7  CCNC(=O)CNC AS-787/43399855 [0,2,0,0,0,0|1,0,0]=3
15  B7R0.16  NC(=O)C(N)C(N)=O AC-907/25014009 [0,2,0,0,0,0|1,0,1]=4
16  B7R0.13  CC(C)(CBr)C(=O)O AQ-917/42754027 [0,2,0,0,0,0|2,0,0]=4
17  B7R0.13  CC(C)(CO)C(=O)O AQ-917/40987623 [0,2,0,0,0,0|2,0,0]=4
18  B7R0.13  CCC(C)(O)C(=O)O AB-131/40897105 [0,2,0,0,0,0|1,0,0]=3
19  B7R0.6  CC(=O)NCC(=O)O AB-131/40177771 [0,2,0,0,0,0|1,0,1]=4
20  B7R1.1  NNC1=NCCN1 AG-690/11353675 [0,1,0,1,0,0|2,0,0]=4
21  B7R1.1  ON=C1CCCC1 AH-034/32464031 [0,1,0,1,0,0|1,0,1]=4
22  B7R1.1  O\N=C1/CCCN1 AG-664/25003377 [0,1,0,1,0,0|0,0,1]=3
23  B7R1.4  NC1CCOC1=O AR-527/43171946 [0,1,0,1,0,0|1,0,0]=3
24  B7R1.18  O=C(O)C1CCC1 AJ-190/40848564 [0,1,0,1,0,0|1,0,0]=3