0  B11R1.172  O=C(O)CCCN1C=CC=N1 8733AC [0,0,0,0,0,0|4,0,0]=4
1  B10R1.21  C#CCNCC1=CC=CO1 9640AC [1,0,0,0,0,0|1,0,2]=4
2  B10R1.21  CCCCCC1=CC=CO1 4832AB [1,0,0,0,0,0|1,0,1]=3
3  B12R1.260  N[C@H](CC(=O)O)CC1=CC=CO1 4422AH [0,1,0,0,0,0|2,0,0]=3
4  B12R1.264  C=C(C)C(=O)OCC1=CC=CO1 7954AL [0,1,0,0,0,0|1,1,1]=4
5  B10R1.66  CC(=O)SCC1=CC=CO1 M900 [0,0,0,0,1,0|0,0,0]=1
6  B10R1.66  CC(=O)\C=C\C1=CC=CS1 Z2375 [0,0,0,0,1,0|0,1,2]=4
7  B10R1.66  O=C(O)CCC1=NC=CS1 W3145 [0,0,0,0,1,0|2,1,0]=4
8  B10R1.66  O=C(O)CCN1C=CC=C1 2198AF [0,0,0,0,1,0|3,0,0]=4
9  B10R1.66  O=C(O)CCN1C=CC=N1 2350AF [0,0,0,0,1,0|3,0,0]=4
10  B12R1.252  CC(=O)COCC1=CC=CC=C1 1360AB [0,0,0,0,0,1|1,1,0]=3
11  B9R1.12  CCCCC1=CC=CS1 Z5462 [2,0,0,0,0,0|0,1,1]=4
12  B9R1.12  CCNCC1=CC=CS1 V6759 [2,0,0,0,0,0|1,1,0]=4
13  B9R1.12  CCOCC1=CC=CO1 Z4965 [2,0,0,0,0,0|0,1,0]=3
14  B9R1.12  O=CCCN1C=CC=N1 5129AH [2,0,0,0,0,0|2,0,0]=4
15  B11R1.35  N[C@@H](CC1=CC=CO1)C(=O)O Q849 [0,1,0,0,1,0|1,0,0]=3
16  B11R1.35  N[C@@H](CC1=CC=CO1)C(=O)O Q870 [0,1,0,0,1,0|1,0,0]=3
17  B11R1.35  N[C@H](CC1=CC=CS1)C(=O)O C958 [0,1,0,0,1,0|1,1,0]=4
18  B11R1.77  N[C@@H](CC(=O)O)C1=CC=CO1 5898AA [0,1,0,0,1,0|1,0,0]=3
19  B11R1.77  N[C@H](CC(=O)O)C1=CC=CS1 1420AC [0,1,0,0,1,0|1,1,0]=4
20  B11R1.510  CC(C)(=O)SCC1=CC=CO1 U493 [0,1,0,0,1,0|0,0,1]=3
21  B13R1.718  COC(=O)CNCC1=CC=CC=C1 W3738 [0,1,0,0,0,1|2,0,0]=4
22  B11R1.91  CC(=O)CSC1=CC=CC=C1 4421AE [0,0,1,1,0,0|1,0,1]=4
23  B11R2.106  O=C1CCCC2=C1C=CO2 8579AA [1,0,0,1,0,0|1,0,0]=3
24  B13R2.10  O=C1CC[C@H](C2=CC=CC=C2)C1 4216AL [0,0,0,1,0,1|2,0,0]=4
25  B9R1.13  O=C(O)CC1=CC=CO1 V2403 [0,0,0,0,2,0|1,0,0]=3
26  B11R1.28  O=CCCCC1=CC=CC=C1 6150AD [1,0,0,0,0,1|2,0,0]=4
27  B13R1.337  O=C(O)CCSCC1=CC=CC=C1 9239AD [0,0,0,0,0,2|2,0,0]=4