0  B5R0.5  CC(N)C(C)O Y13729 [0,0,0,0,0,0|2,0,2]=4
1  B5R0.5  C[C@H](N)[C@H](C)O F16993 [0,0,0,0,0,0|2,0,2]=4
2  B4R0.1  C=C[C@H](C)N N11431 [1,0,0,0,0,0|2,0,1]=4
3  B6R0.3  C=CC(=O)C(=O)O AC9460 [0,1,0,0,0,0|0,0,1]=2
4  B6R0.3  C=C[C@H](N)C(=O)O F31036 [0,1,0,0,0,0|1,0,2]=4
5  B6R0.3  CC(C)C(=O)CN AT23528 [0,1,0,0,0,0|2,0,1]=4
6  B6R0.3  C[C@@H](CN)C(=O)O 31999 [0,1,0,0,0,0|1,0,1]=3
7  B6R0.3  N[C@H](CS)S(=O)O D72263 [0,1,0,0,0,0|2,0,1]=4
8  B6R0.3  O=C(CBr)C(F)F AT12824 [0,1,0,0,0,0|2,0,1]=4
9  B6R1.4  N[C@H]1CNC1=O P11921 [0,0,0,1,0,0|2,0,1]=4
10  B6R0.2  O=C(O)CC(F)F P18472 [0,0,0,0,0,1|2,0,1]=4
11  B5R0.1  CN(C)NC=O 20013 [1,1,0,0,0,0|2,0,0]=4
12  B7R0.10  C=C(OC)C(=O)OC 78623 [0,2,0,0,0,0|1,0,0]=3
13  B7R0.13  C[C@](N)(CO)C(=O)O F15126 [0,2,0,0,0,0|0,0,2]=4
14  B7R0.13  NCC(F)(F)C(=O)O AC6133 [0,2,0,0,0,0|1,0,1]=4
15  B7R0.15  CN[C@@H](CS)C(=O)O AC8363 [0,2,0,0,0,0|0,1,1]=4
16  B7R1.2  C[C@@H]1COC(=O)C1 64712 [0,0,0,1,0,1|1,0,1]=4
17  B7R1.2  C[C@@H]1COC(=O)C1 69011 [0,0,0,1,0,1|1,0,1]=4
18  B7R1.2  NC1=NCC(=O)S1 C13281 [0,0,0,1,0,1|2,0,0]=4
19  B7R1.12  C[C@@H]1C[C@@H]1C(=O)O 55219 [0,0,0,1,0,1|1,0,1]=4
20  B7R1.12  C[C@@H]1C[C@@H]1C(=O)O P17920 [0,0,0,1,0,1|1,0,1]=4
21  B7R1.12  O=C(O)[C@@H]1C[C@@H]1I CS3132 [0,0,0,1,0,1|1,0,1]=4
22  B7R1.12  O=C(O)[C@@H]1C[C@@H]1I D79124 [0,0,0,1,0,1|1,0,1]=4
23  B7R1.12  O=C(O)[C@H]1C[C@@H]1F P14126 [0,0,0,1,0,1|1,0,1]=4
24  B7R1.18  O=C(O)[C@@H]1CCO1 P18794 [0,1,0,1,0,0|0,0,2]=4
25  B7R1.18  O=C(O)[C@@H]1CCO1 P18795 [0,1,0,1,0,0|0,0,2]=4