0  B7R0.11  COCC(C)(C)CN 4090889 [0,0,0,0,0,0|3,0,1]=4
1  B6R0.1  CNCC(C)OC 4089097 [1,0,0,0,0,0|0,0,2]=3
2  B6R0.5  CC(C)(C)CNN 4088354 [1,0,0,0,0,0|1,0,1]=3
3  B6R0.5  CNCC(C)(C)C 4088888 [1,0,0,0,0,0|0,0,2]=3
4  B6R0.5  COCC(C)(C)N 4088100 [1,0,0,0,0,0|2,0,1]=4
5  B8R1.72  CC1(C)CCNCC1 4090776 [0,0,0,1,0,0|3,0,0]=4
6  B5R0.2  COCCNN 4050590 [2,0,0,0,0,0|1,0,1]=4
7  B5R0.2  COCCNN 4089703 [2,0,0,0,0,0|1,0,1]=4
8  B5R0.3  CCC(C)NC 4039876 [2,0,0,0,0,0|1,0,1]=4
9  B5R0.3  CCC(C)NC 4089297 [2,0,0,0,0,0|1,0,1]=4
10  B5R0.3  COC(C)CN 4089925 [2,0,0,0,0,0|0,0,1]=3
11  B5R0.3  CO[C@@H](C)C#N 4030194 [2,0,0,0,0,0|0,0,2]=4
12  B5R0.3  CO[C@@H](C)CO 4031352 [2,0,0,0,0,0|1,0,0]=3
13  B7R0.8  CC(C)(C)CCCN 4041483 [1,1,0,0,0,0|1,0,1]=4
14  B7R0.8  CCNCC(C)(C)C 4090473 [1,1,0,0,0,0|0,0,2]=4
15  B7R0.14  CNC(C)C(C)(C)C 4089219 [1,1,0,0,0,0|0,0,2]=4
16  B7R1.1  COC1CCNC1 4089940 [1,0,0,1,0,0|0,0,2]=4
17  B7R1.1  CO[C@@H]1CCNC1 4098907 [1,0,0,1,0,0|0,0,2]=4
18  B7R1.1  CO[C@H]1CCNC1 4093842 [1,0,0,1,0,0|0,0,2]=4
19  B7R1.3  CC1CNCCO1 4090031 [1,0,0,1,0,0|0,0,2]=4
20  B7R1.3  C[C@@H]1CNCCO1 4037141 [1,0,0,1,0,0|0,0,2]=4
21  B7R1.10  COC1CC(N)C1 4035443 [1,0,0,1,0,0|2,0,0]=4
22  B7R1.10  CO[C@H]1C[C@@H](N)C1 4048109 [1,0,0,1,0,0|2,0,0]=4
23  B7R1.10  CO[C@H]1C[C@@H](O)C1 4069248 [1,0,0,1,0,0|2,0,0]=4