0  B6R1.2  CC1=CC=NN1 S5146 [0,0,0,0,0,0|2,0,0]=2
1  B6R1.2  CC1=CNN=C1 S1717 [0,0,0,0,0,0|0,0,0]=0
2  B6R1.2  CC1=CNN=C1 S1717 [0,0,0,0,0,0|0,0,0]=0
3  B5R1.1  C1=CN=CN1 S6006 [1,0,0,0,0,0|2,0,0]=3
4  B7R1.4  CN1C=CNC1=S S1609 [0,1,0,0,0,0|2,0,0]=3
5  B7R1.4  CN1C=CNC1=S S1609 [0,1,0,0,0,0|2,0,0]=3
6  B7R1.3  C1=CC(=O)NC=C1 S6360 [0,0,0,0,0,1|3,0,0]=4
7  B7R1.3  C1=CN=CC=C1N S5028 [0,0,0,0,0,1|2,0,0]=3
8  B4R0.1  C(=NN)(N)N S4548 [1,0,1,0,0,0|2,0,0]=4
9  B4R0.1  C(=NN)(N)N S4548 [1,0,1,0,0,0|2,0,0]=4
10  B4R0.1  C=CC(=O)N S6227 [1,0,1,0,0,0|2,0,0]=4
11  B4R0.1  CC(=O)NO S4602 [1,0,1,0,0,0|2,0,0]=4
12  B4R0.1  CC(=O)NO S4602 [1,0,1,0,0,0|2,0,0]=4
13  B6R0.3  CC(=NO)C(=O)C S3699 [0,1,1,0,0,0|2,0,0]=4
14  B8R1.2  C1=CC=C(C=C1)CO S4600 [0,1,0,0,0,1|2,0,0]=4
15  B8R1.2  C1=CC=C(C=C1)CO S4600 [0,1,0,0,0,1|2,0,0]=4
16  B8R1.3  CC1=CC=C(O)C=C1 S6017 [0,1,0,0,0,1|2,0,0]=4
17  B8R1.4  C1=C(NC(=O)N=C1)N S4893 [0,1,0,0,0,1|2,0,0]=4
18  B8R1.4  C1=CN=C(NC1=O)N S6256 [0,1,0,0,0,1|2,0,0]=4
19  B8R1.4  C1=CNC(=O)NC1=O S4177 [0,1,0,0,0,1|2,0,0]=4
20  B8R1.4  C1=CNC(=S)NC1=O S3100 [0,1,0,0,0,1|2,0,0]=4
21  B8R1.4  C1=CNC(=S)NC1=O S3100 [0,1,0,0,0,1|2,0,0]=4
22  B8R1.4  CC1=CC=CC(=C1)O S6331 [0,1,0,0,0,1|2,0,0]=4
23  B8R1.5  C1=CN=CC(=C1N)N S4622 [0,1,0,0,0,1|2,0,0]=4
24  B8R1.5  C1=CN=CC(=C1N)N S4622 [0,1,0,0,0,1|2,0,0]=4
25  B8R1.5  CC1=C(O)C=CC=C1 S6199 [0,1,0,0,0,1|2,0,0]=4
26  B8R1.8  C1=C(NC=N1)CCN S3968 [0,2,0,0,0,0|2,0,0]=4
27  B8R1.8  C1=C(NC=N1)CCN S4117 [0,2,0,0,0,0|2,0,0]=4
28  B8R1.8  C1=C(NC=N1)CCN S4118 [0,2,0,0,0,0|2,0,0]=4
29  B8R1.8  C1=C(NC=N1)CCN S4118 [0,2,0,0,0,0|2,0,0]=4
30  B8R1.8  C1=C(NN=C1)CCN S6612 [0,2,0,0,0,0|2,0,0]=4
31  B8R1.8  C1=C(NN=C1)CCN S6612 [0,2,0,0,0,0|2,0,0]=4
32  B8R1.18  CC1=CC(=NN1C)C S5147 [0,2,0,0,0,0|2,0,0]=4