0  B6R0.8  C#CC(C)(N)CC AC-9136 [1,0,0,0,0,0|2,0,1]=4
1  B6R0.8  CC(C)(C=O)CO AC-366 [1,0,0,0,0,0|1,0,2]=4
2  B8R1.52  N#CC1(N)CCOC1 AC-29865 [0,0,0,1,0,0|2,0,1]=4
3  B5R0.3  C=C[C@@H](N)CO AC-30956 [2,0,0,0,0,0|1,0,1]=4
4  B5R0.3  NC(CO)CO AC-13723 [2,0,0,0,0,0|0,0,0]=2
5  B5R0.3  NCC(O)CN AC-3376 [2,0,0,0,0,0|2,0,0]=4
6  B5R0.3  NCC(O)CO AC-23129 [2,0,0,0,0,0|1,0,0]=3
7  B5R0.3  NC[C@@H](O)CO AC-7033 [2,0,0,0,0,0|1,0,0]=3
8  B5R0.3  NC[C@H](O)CCl AC-26415 [2,0,0,0,0,0|2,0,0]=4
9  B5R0.3  NC[C@H](O)CO AC-13922 [2,0,0,0,0,0|1,0,0]=3
10  B5R0.3  NC[C@H](O)CO AC-7162 [2,0,0,0,0,0|1,0,0]=3
11  B5R0.3  OC[C@@H](O)CCl AC-7038 [2,0,0,0,0,0|1,0,0]=3
12  B5R0.3  OC[C@H](O)CCl AC-7037 [2,0,0,0,0,0|1,0,0]=3
13  B5R0.4  CC(C)(C)CN AC-26539 [2,0,0,0,0,0|2,0,0]=4
14  B5R0.4  CC(C)(O)CN AC-25613 [2,0,0,0,0,0|2,0,0]=4
15  B7R0.13  CC(C)(CO)C(=O)O AC-29208 [1,1,0,0,0,0|1,0,1]=4
16  B7R0.13  CC[C@@](C)(N)C(=O)O AC-4457 [1,1,0,0,0,0|1,0,1]=4
17  B7R0.13  CC[C@](C)(N)C(=O)O AC-4458 [1,1,0,0,0,0|1,0,1]=4
18  B7R0.13  C[C@@](N)(CO)C(=O)O AC-3443 [1,1,0,0,0,0|0,0,1]=3
19  B7R0.13  C[C@](N)(CO)C(=O)O AC-2370 [1,1,0,0,0,0|0,0,1]=3
20  B7R0.15  CC[C@H](CO)C(=O)O AC-9520 [1,1,0,0,0,0|1,0,1]=4
21  B7R1.25  CC1(CO)COC1 AC-2106 [1,0,0,1,0,0|1,0,0]=3
22  B7R1.29  OCC1(CO)CC1 AC-9618 [1,0,0,1,0,0|1,0,0]=3
23  B7R1.1  OCC1CCNC1 AC-26851 [1,0,0,1,0,0|2,0,0]=4
24  B7R1.1  OC[C@@H]1CCNC1 AC-22425 [1,0,0,1,0,0|2,0,0]=4
25  B7R1.1  OC[C@H]1CCNC1 AC-22424 [1,0,0,1,0,0|2,0,0]=4
26  B9R1.134  COCC1(N)CCCC1 AC-7882 [0,1,0,1,0,0|2,0,0]=4