0  B14R1.818  CC(=O)CC(=O)NCC1=CC=CC=C1 CS-W015848 [0,0,0,0,0,0|2,0,1]=3
1  B14R1.818  O=C(O)CC(=O)OCC1=CC=CC=C1 CS-0091017 [0,0,0,0,0,0|2,0,1]=3
2  B13R1.42  NCCC(=O)OCC1=CC=CC=C1 CS-W009807 [1,0,0,0,0,0|1,0,0]=2
3  B15R1.741  C[C@H](CO)NC(=O)OCC1=CC=CC=C1 CS-W015161 [0,1,0,0,0,0|1,0,0]=2
4  B15R1.3678  [C@@H](N)(C(=O)OCC1=CC=CC=C1)C(C)C CS-W019024 [0,1,0,0,0,0|0,0,0]=1
5  B15R2.325  NC1CC(=O)N(CC2=CC=CC=C2)C1 CS-0044422 [0,0,0,1,0,0|2,0,0]=3
6  B13R1.351  C[C@H](N)C(=O)OCC1=CC=CC=C1 CS-W020701 [0,0,0,0,1,0|1,0,0]=2
7  B15R1.5919  O=C(O)CNC(=O)OCC1=CC=CC=C1 CS-W018534 [0,0,0,0,0,1|2,0,1]=4
8  B12R1.27  NNC(=O)OCC1=CC=CC=C1 CS-W016057 [2,0,0,0,0,0|2,0,0]=4
9  B12R1.27  O=C(CBr)OCC1=CC=CC=C1 CS-W010391 [2,0,0,0,0,0|1,0,0]=3
10  B12R1.27  O=C(CO)OCC1=CC=CC=C1 CS-W007485 [2,0,0,0,0,0|1,0,0]=3
11  B14R1.32  CCOC(=O)CCC1=CC(C)=CC=C1 CS-M2098 [1,1,0,0,0,0|2,0,0]=4
12  B14R1.60  CCOC(=O)[C@@H](N)CC1=CC=CC=C1 CS-W012971 [1,1,0,0,0,0|2,0,0]=4
13  B14R1.156  O=C(NCCO)OCC1=CC=CC=C1 CS-W004853 [1,1,0,0,0,0|1,0,0]=3
14  B14R1.502  CCOC(=O)CCC1=CC=C(Br)C=C1 CS-W012554 [1,1,0,0,0,0|2,0,0]=4
15  B14R1.502  CCOC(=O)CCC1=CC=C(Cl)C=C1 CS-M2499 [1,1,0,0,0,0|2,0,0]=4
16  B14R1.433  CC(C)(C)OC(=O)OC1=CC=CC=C1 CS-W010657 [0,1,0,0,1,0|1,0,0]=3
17  B14R1.3099  CC(C)(N)C(=O)OCC1=CC=CC=C1 CS-0096008 [0,1,0,0,1,0|0,0,0]=2
18  B16R1.12572  [C@@H](N)(CC1=CC=CC=C1)C(=O)OC(C)(C)C CS-W008522 [0,2,0,0,0,0|2,0,0]=4
19  B16R1.1040  CC(C)(C)OC(=O)NCC1=CC=C(Br)C=C1 CS-W005364 [0,2,0,0,0,0|2,0,0]=4
20  B14R2.21  O=C1COC[C@@H](C2=CC=CC=C2)N1 CS-D1768 [1,0,0,1,0,0|2,0,0]=4
21  B14R2.598  CC1NC(=O)CC1C2=CC=CC=C2 CS-0108148 [1,0,0,1,0,0|2,0,0]=4
22  B12R1.32  CCOC(=O)CC1=CC=CC=C1 CS-W016087 [1,0,0,0,1,0|1,0,0]=3
23  B12R1.32  CCOC(=O)CC1=CC=NC=C1 CS-W017889 [1,0,0,0,1,0|2,0,0]=4
24  B12R1.107  CC(=O)CC(=O)C1=CC=CC=C1 CS-W014323 [0,0,0,0,2,0|1,0,1]=4
25  B12R1.107  CC(C)C[C@H](N)C1=CC=CC=C1 CS-0097724 [0,0,0,0,2,0|1,0,1]=4
26  B14R1.520  CCOC(=O)CNCC1=CC=CC=C1 CS-M0975 [1,0,0,0,0,1|2,0,0]=4
27  B14R1.520  CCOC(=O)CNCC1=CC=CC=C1 CS-W010686 [1,0,0,0,0,1|2,0,0]=4