0  B4R0.1  CC(C)NN WX684009 [0,1,0,0,0,0|2,0,0]=3
1  B4R0.1  CCC(=N)N WX619910 [0,1,0,0,0,0|3,0,0]=4
2  B4R0.3  CS(=N)(=O)C WXC02977 [0,1,0,0,0,0|0,0,1]=2
3  B4R1.2  C1CC1N WX604562 [0,0,0,1,0,0|2,0,0]=3
4  B5R0.1  C(CF)C(=O)O WX610266 [0,2,0,0,0,0|2,0,0]=4
5  B5R0.1  CC(=O)CNC WX600212 [0,2,0,0,0,0|1,0,0]=3
6  B5R0.1  CC(=O)\C=N\O WX690228 [0,2,0,0,0,0|1,0,1]=4
7  B5R0.1  CC(C)CNN WX684055 [0,2,0,0,0,0|2,0,0]=4
8  B5R0.1  CC(CNN)O WX684013 [0,2,0,0,0,0|1,0,1]=4
9  B5R0.1  CC(CNN)O WX684431 [0,2,0,0,0,0|1,0,1]=4
10  B5R0.1  C[C@H](CC=C)O WX685032 [0,2,0,0,0,0|1,0,1]=4
11  B5R0.3  C(C(=O)NN)O WX684421 [0,2,0,0,0,0|2,0,0]=4
12  B5R0.3  CC(CN)CCl WX600337 [0,2,0,0,0,0|2,0,0]=4
13  B5R0.3  CCC(C)NN WX684015 [0,2,0,0,0,0|2,0,0]=4
14  B5R0.3  CC[C@H](C)C#C WXC02726 [0,2,0,0,0,0|2,0,0]=4
15  B5R0.4  CC(C)(CN)O WX600104 [0,2,0,0,0,0|1,0,1]=4
16  B5R0.4  CC(CN)(F)F WX600332 [0,2,0,0,0,0|2,0,0]=4
17  B5R0.5  CN(C)C(=N)N WX619912 [0,2,0,0,0,0|2,0,0]=4
18  B5R0.5  CN(C)C(=N)N WX619935 [0,2,0,0,0,0|2,0,0]=4
19  B5R1.2  C1C(=O)CN1 WXC03556 [0,1,0,1,0,0|1,0,0]=3
20  B5R1.2  C1C(=O)CO1 WX625042 [0,1,0,1,0,0|1,0,0]=3
21  B5R1.2  C1C(CN1)F WX604199 [0,1,0,1,0,0|2,0,0]=4
22  B5R1.2  C1C(CN1)O WX604205 [0,1,0,1,0,0|1,0,1]=4
23  B5R1.2  C1C(CO1)N WX604200 [0,1,0,1,0,0|2,0,0]=4
24  B5R1.2  C1CC(C1)O WX642079 [0,1,0,1,0,0|1,0,1]=4
25  B5R1.2  CC1CCN1 WX604557 [0,1,0,1,0,0|2,0,0]=4
26  B5R1.2  CC1CNC1 WX604558 [0,1,0,1,0,0|2,0,0]=4
27  B5R1.3  C1CC1CO WX640290 [0,1,0,1,0,0|1,0,1]=4
28  B5R1.3  C1CC1NN WXC03921 [0,1,0,1,0,0|2,0,0]=4
29  B5R1.3  CNC1CC1 WX600338 [0,1,0,1,0,0|2,0,0]=4
30  B5R1.3  CNC1CC1 WX604563 [0,1,0,1,0,0|2,0,0]=4
31  B5R1.4  CC1CC1N WX604181 [0,1,0,1,0,0|2,0,0]=4
32  B5R1.4  CC1CC1N WX604564 [0,1,0,1,0,0|2,0,0]=4
33  B5R1.4  C[C@@H]1C[C@H]1N WX601308 [0,1,0,1,0,0|2,0,0]=4
34  B5R1.5  CC1(CC1)N WX600041 [0,1,0,1,0,0|2,0,0]=4
35  B5R1.5  CC1(CC1)N WX604565 [0,1,0,1,0,0|2,0,0]=4