0  B4R0.1  CC(C)NN WX684009 [0,0,0,0,0,0|3,0,1]=4
1  B4R0.1  CCC(=N)N WX619910 [0,0,0,0,0,0|4,0,0]=4
2  B5R0.1  C(CF)C(=O)O WX610266 [0,1,0,0,0,0|3,0,0]=4
3  B5R0.1  CC(=O)CNC WX600212 [0,1,0,0,0,0|2,0,0]=3
4  B5R0.1  CC(=O)\C=N\O WX690228 [0,1,0,0,0,0|1,0,0]=2
5  B5R0.3  C(C(=O)NN)O WX684421 [0,1,0,0,0,0|2,0,0]=3
6  B5R0.5  CC(C(=N)N)O WX619923 [0,1,0,0,0,0|3,0,0]=4
7  B5R1.2  C1C(=O)CN1 WXC03556 [0,0,0,1,0,0|2,0,0]=3
8  B5R1.2  C1C(=O)CO1 WX625042 [0,0,0,1,0,0|1,0,0]=2
9  B5R1.2  C1C(CO1)N WX604200 [0,0,0,1,0,0|2,0,1]=4
10  B5R1.3  C1CC1CO WX640290 [0,0,0,1,0,0|2,0,1]=4
11  B4R0.2  C(=C\N)/C=O WXC00375 [1,1,0,0,0,0|2,0,0]=4
12  B4R0.3  CS(=N)(=O)C WXC02977 [1,1,0,0,0,0|2,0,0]=4
13  B6R0.1  CCNC(=O)CCl WX630212 [0,2,0,0,0,0|2,0,0]=4
14  B6R0.1  CNC(=O)CC#N WX619018 [0,2,0,0,0,0|2,0,0]=4
15  B6R0.1  CNCC(=O)NC WX600331 [0,2,0,0,0,0|2,0,0]=4
16  B6R0.2  C\C(=C\C(=O)O)\I WXC02281 [0,2,0,0,0,0|2,0,0]=4
17  B6R0.3  C([C@H](C(=O)N)N)O WX665005 [0,2,0,0,0,0|2,0,0]=4
18  B6R0.3  CC(C)C(=N)NO WX619096 [0,2,0,0,0,0|2,0,0]=4
19  B6R0.3  CC(C)C(=O)NN WX684019 [0,2,0,0,0,0|2,0,0]=4
20  B6R0.3  CC(C)\C(=N\O)\N WX690138 [0,2,0,0,0,0|2,0,0]=4
21  B6R0.3  CN(C)C(=O)CI WX630194 [0,2,0,0,0,0|2,0,0]=4
22  B6R0.3  CNC(=O)C(=O)O WXC01945 [0,2,0,0,0,0|1,0,0]=3
23  B6R0.3  COC(=O)C(=N)N WX619922 [0,2,0,0,0,0|1,0,1]=4
24  B6R0.4  CC(=C)CCCO WX640339 [0,2,0,0,0,0|2,0,0]=4
25  B6R0.7  CC(=O)C(C)(C)N WX600266 [0,2,0,0,0,0|2,0,0]=4