0  B8R1.8  CCSC1=CN=NS1 ACI-00621 [0,0,0,0,0,0|4,0,0]=4
1  B8R1.8  NCCC1=CC=CS1 SB-11D-001 [0,0,0,0,0,0|0,0,0]=0
2  B7R1.1  NCC1=CSC=C1 ACI-00305 [1,0,0,0,0,0|2,0,0]=3
3  B7R1.1  O=CC1=CC=NS1 ACI-NI-00774 [1,0,0,0,0,0|2,0,1]=4
4  B7R1.1  OCC1=CN=CN1 ACI-01502 [1,0,0,0,0,0|3,0,0]=4
5  B7R1.1  OCC1=CN=CS1 ACI-00689 [1,0,0,0,0,0|2,0,0]=3
6  B9R1.7  CCCC1=NN=C(S)S1 ACI-00926 [0,1,0,0,0,0|3,0,0]=4
7  B9R1.11  COC(=N)C1=CC=CS1 WS-04A-006 [0,1,0,0,0,0|2,0,1]=4
8  B9R1.11  N\C(=N/O)C1=CC=CS1 ACI-NI-00203 [0,1,0,0,0,0|2,0,1]=4
9  B9R1.11  O=C(CBr)C1=CC=CS1 ACI-01812 [0,1,0,0,0,0|1,0,1]=3
10  B9R1.12  S=C=NCC1=CC=CO1 ACI-00338 [0,1,0,0,0,0|1,1,1]=4
11  B9R1.8  NOCC1=CC=CC=C1 ACI-01578 [0,0,0,0,0,1|2,0,0]=3
12  B6R1.2  BrC1=CC=NS1 ACI-NI-00773 [2,0,0,0,0,0|2,0,0]=4
13  B6R1.2  CC1=CC=NS1 ACI-NI-00772 [2,0,0,0,0,0|1,0,0]=3
14  B6R1.2  CC1=NSC=C1 ACI-00539 [2,0,0,0,0,0|2,0,0]=4
15  B6R1.2  NC1=CC=NO1 ACI-00943 [2,0,0,0,0,0|1,1,0]=4
16  B6R1.2  NC1=NC=CO1 ACI-00944 [2,0,0,0,0,0|1,1,0]=4
17  B6R1.2  NC1=NNC=C1 ACI-03851 [2,0,0,0,0,0|2,0,0]=4
18  B8R1.1  CC1=CC(CN)=NO1 JM-11D-001 [1,1,0,0,0,0|2,0,0]=4
19  B8R1.1  CC1=NOC(CN)=C1 JM-05I-002 [1,1,0,0,0,0|1,1,0]=4
20  B8R1.1  NCC1=CN=C(Br)S1 ACI-04677 [1,1,0,0,0,0|1,0,0]=3
21  B8R1.1  O=CC1=CC(I)=CS1 ACI-02692 [1,1,0,0,0,0|1,0,1]=4
22  B8R1.1  OCC1=CN=C(Br)S1 ACI-03791 [1,1,0,0,0,0|2,0,0]=4
23  B8R1.7  N=C(N)C1=CC=CS1 ACI-NI-00211 [1,1,0,0,0,0|0,0,1]=3
24  B8R1.7  NC(=O)C1=CC=CO1 ACI-02007 [1,1,0,0,0,0|0,1,1]=4
25  B8R1.7  NC(=O)C1=CC=NS1 ACI-05371 [1,1,0,0,0,0|1,0,1]=4
26  B8R1.7  NC(=O)C1=NC=CS1 ACI-05426 [1,1,0,0,0,0|1,0,1]=4
27  B8R1.7  NC(=S)C1=CC=CS1 ACI-NI-00215 [1,1,0,0,0,0|0,0,1]=3
28  B8R1.11  CC1=C(CN)C=CO1 JM-10L-001 [1,1,0,0,0,0|2,0,0]=4
29  B8R1.11  CC1=C(CN)SC=C1 ACI-04730 [1,1,0,0,0,0|0,0,0]=2
30  B8R1.11  CC1=C(CO)OC=C1 ACI-02282 [1,1,0,0,0,0|1,1,0]=4
31  B8R1.11  CC1=C(CO)SC=N1 ACI-00573 [1,1,0,0,0,0|2,0,0]=4
32  B8R1.11  O=CC1=C(Br)C=CS1 ACI-00955 [1,1,0,0,0,0|1,0,1]=4
33  B10R1.17  BrCCOC1=CC=CC=C1 ACI-01603 [0,1,0,0,0,1|2,0,0]=4
34  B10R1.17  OCCSC1=CC=CC=C1 ACI-02409 [0,1,0,0,0,1|2,0,0]=4
35  B10R1.18  NC(=S)CC1=CC=CC=C1 SB-02C-001 [0,1,0,0,0,1|1,0,1]=4
36  B10R1.11  CCOC(=N)C1=CC=CS1 ACI-00584 [0,2,0,0,0,0|1,0,1]=4
37  B10R1.21  O=C=NCCC1=CC=CS1 ACI-00385 [0,2,0,0,0,0|0,0,1]=3
38  B10R2.136  C1=CN(C2CNC2)N=C1 ACI-03812 [0,1,0,1,0,0|2,0,0]=4