0  B5R0.3  CC[C@H](O)CN 4038369 [0,0,0,0,0,0|2,1,0]=3
1  B4R0.1  CC(=O)CN 4088212 [1,0,0,0,0,0|1,1,1]=4
2  B4R0.1  CC(C)NN 4091043 [1,0,0,0,0,0|3,0,0]=4
3  B6R0.3  CC(C)[C@@H](O)CN 4038006 [0,1,0,0,0,0|2,1,0]=4
4  B6R0.3  CC(C)[C@H](O)CN 4038978 [0,1,0,0,0,0|2,1,0]=4
5  B6R0.8  CCC(C)(N)CC 4088869 [0,1,0,0,0,0|3,0,0]=4
6  B6R1.4  N[C@H]1CC[C@@H]1O 4085482 [0,0,0,1,0,0|2,0,0]=3
7  B6R1.4  N[C@H]1CC[C@H]1O 4085481 [0,0,0,1,0,0|2,0,0]=3
8  B6R1.7  CCC1(N)CC1 4090334 [0,0,0,1,0,0|3,0,0]=4
9  B5R1.4  C[C@@H]1C[C@H]1N 4045459 [1,0,0,1,0,0|2,0,0]=4
10  B5R1.5  CC1(N)CC1 4089893 [1,0,0,1,0,0|2,0,0]=4
11  B7R1.1  OCC1CCCN1 3020449 [0,1,0,1,0,0|2,0,0]=4
12  B7R1.3  NC1CCCOC1 4089910 [0,1,0,1,0,0|2,0,0]=4
13  B7R1.4  N[C@H]1COC[C@@H]1O 4089150 [0,1,0,1,0,0|1,1,0]=4
14  B7R1.4  N[C@H]1COC[C@H]1O 4088570 [0,1,0,1,0,0|1,1,0]=4
15  B7R1.4  O[C@H]1CNC[C@@H]1F 4034089 [0,1,0,1,0,0|2,0,0]=4
16  B7R1.4  O[C@H]1CNC[C@H]1O 4045291 [0,1,0,1,0,0|1,1,0]=4