0  B5R0.1  CSCC(=O)O ACI-04646 [0,0,0,0,0,0|1,0,0]=1
1  B4R0.1  CSC(=N)N RH-05B-002 [1,0,0,0,0,0|2,0,0]=3
2  B4R0.1  C\C(N)=N\O ACI-00899 [1,0,0,0,0,0|2,1,0]=4
3  B4R0.1  N=C(N)CCl ACI-00205 [1,0,0,0,0,0|3,0,0]=4
4  B4R0.2  CSCCN ACI-00500 [1,0,0,0,0,0|1,0,1]=3
5  B6R0.1  COC\C(N)=N\O ACI-05005 [0,1,0,0,0,0|1,1,1]=4
6  B6R0.2  CC(=O)\C=C(\C)N ACI-01061 [0,1,0,0,0,0|1,0,1]=3
7  B6R0.3  CC(=O)C(C)CO ACI-02297 [0,1,0,0,0,0|2,0,0]=3
8  B6R0.4  C=CCCC(=O)Cl FD-10I-003 [0,1,0,0,0,0|2,0,1]=4
9  B6R0.4  C=CCCC(N)=O ACI-05452 [0,1,0,0,0,0|2,0,1]=4
10  B6R0.4  O=C(O)\C=C\CBr ACI-04789 [0,1,0,0,0,0|2,0,1]=4
11  B6R1.2  CC1=CSN=C1 ACI-NI-00745 [0,0,0,1,0,0|2,0,1]=4
12  B6R1.2  CC1=CSN=N1 ACI-05802 [0,0,0,1,0,0|2,0,1]=4
13  B6R1.2  CC1=NSC=C1 ACI-00539 [0,0,0,1,0,0|2,0,1]=4
14  B6R1.2  O=C1C=CSN1 ACI-04102 [0,0,0,1,0,0|1,0,2]=4
15  B6R1.11  N=C(N)C1CC1 TB-03I-002 [0,0,0,1,0,0|3,0,0]=4
16  B5R0.3  CC\C(N)=N\O JM-05F-002 [1,1,0,0,0,0|1,0,1]=4
17  B5R0.3  CSC(=S)NN ACI-05565 [1,1,0,0,0,0|1,1,0]=4
18  B5R0.5  CC(C)C(=N)N ACI-00383 [1,1,0,0,0,0|2,0,0]=4
19  B5R0.5  CC(C)C(N)=S ACI-01566 [1,1,0,0,0,0|1,1,0]=4
20  B7R0.2  CC(=O)OC(Br)CBr ACI-00499 [0,2,0,0,0,0|2,0,0]=4
21  B7R0.2  CC(C)CC(=O)CBr ACI-03762 [0,2,0,0,0,0|1,0,0]=3
22  B7R0.2  CCC(=O)CC(=O)O FD-09A-003 [0,2,0,0,0,0|2,0,0]=4
23  B7R0.3  C=CCNC(=O)CCl WS-04B-002 [0,2,0,0,0,0|1,0,1]=4
24  B7R0.3  COC(=O)CCC=O ACI-01008 [0,2,0,0,0,0|1,0,1]=4
25  B7R0.10  COC(=O)C(Cl)C=O ACI-01197 [0,2,0,0,0,0|2,0,0]=4
26  B7R0.15  CNC(CS)C(=O)O JL-11I-006 [0,2,0,0,0,0|2,0,0]=4
27  B7R1.4  N[C@H]1CCOC1=O ACI-02543 [0,1,0,1,0,0|2,0,0]=4
28  B7R1.18  C1(C(=O)O)CCN1 ACI-00777 [0,1,0,1,0,0|2,0,0]=4