0  B22R3.35950  OC(=O)C1CCCCC1C(=O)N2CCc3c2cccc3 1P019IEI [0,0,0,1,0,0|0,0,0]=1
1  B22R3.35950  OC(=O)[C@@H]1CCCC[C@@H]1C(=O)N2CCc3c2cccc3 1P028O2W [0,0,0,1,0,0|0,0,0]=1
2  B22R3.335151  NC(=O)[C@@H]1CC[C@@H]2CN1C(=O)N2OCc3ccccc3 1P000IXL [0,0,0,1,0,0|3,0,0]=4
3  B22R3.335151  OC(=O)[C@@H]1CC[C@@H]2CN1C(=O)N2OCc3ccccc3 1P000EPB [0,0,0,1,0,0|2,0,0]=3
4  B20R2.10746  NC(=O)C1CCCCN1C(=O)OCc2ccccc2 1P00GSCN [0,0,0,0,1,0|3,0,0]=4
5  B20R2.10746  NC(=O)[C@@H]1CCCCN1C(=O)OCc2ccccc2 1P00EB69 [0,0,0,0,1,0|3,0,0]=4
6  B20R2.10746  O=C([C@@H]1CCCC[C@@H]1C(=O)O)OCc2ccccc2 1P00IMJG [0,0,0,0,1,0|1,0,0]=2
7  B20R2.10746  OC(=O)C1CCCCN1C(=O)OCc2ccccc2 1P00FCO9 [0,0,0,0,1,0|2,0,0]=3
8  B20R2.10746  OC(=O)C1COCCN1C(=O)OCc2ccccc2 1P00BD2D [0,0,0,0,1,0|3,0,0]=4
9  B20R2.10746  OC(=O)[C@@H]1CCCCN1C(=O)OCc2ccccc2 1P003CV9 [0,0,0,0,1,0|2,0,0]=3
10  B20R2.10746  OC(=O)[C@@H]1COCCN1C(=O)OCc2ccccc2 1P0056D8 [0,0,0,0,1,0|3,0,0]=4
11  B20R2.10746  [O-]C(=O)C1CCCCN1C(=O)OCc2ccccc2 1P002WLU [0,0,0,0,1,0|2,0,1]=4
12  B20R2.10746  [O-]C(=O)[C@H]1CCCCN1C(=O)OCc2ccccc2 1P002WLT [0,0,0,0,1,0|2,0,1]=4
13  B19R1.25715  OC(=O)CCCCCCCCCCc1ccccc1 1P00CJS3 [1,0,1,0,0,0|1,0,1]=4
14  B21R2.21089  COC(=O)C1CCCCN1C(=O)OCc2ccccc2 1P0022N7 [0,1,0,0,1,0|2,0,0]=4
15  B21R2.222031  CC1CCCN(C1C(=O)O)C(=O)OCc2ccccc2 1P00HZQM [0,1,0,0,1,0|2,0,0]=4
16  B21R2.225975  CC1CCN(C(C1)C(=O)O)C(=O)OCc2ccccc2 1P019F47 [0,1,0,0,1,0|2,0,0]=4
17  B21R2.225975  FC1CCN(C(C1)C(=O)O)C(=O)OCc2ccccc2 1P028Q26 [0,1,0,0,1,0|2,0,0]=4
18  B21R2.225975  F[C@H]1CCN([C@@H](C1)C(=O)O)C(=O)OCc2ccccc2 1P00HJAE [0,1,0,0,1,0|2,0,0]=4
19  B21R2.256669  O=C(N1CCCCC1(C)C(=O)O)OCc2ccccc2 1P003WTJ [0,1,0,0,1,0|2,0,0]=4
20  B23R3.707366  OC(=O)C1CCCCC1C(=O)N2C(C)Cc3c2cccc3 1P01AAUF [0,1,0,1,0,0|0,0,0]=2
21  B19R1.11978  CCCCN(C(=O)OCc1ccccc1)CC(=O)O 1P01G3K1 [0,0,1,0,1,0|2,0,0]=4
22  B19R1.25728  OC(=O)CCCCCCC(=O)OCc1ccccc1 1P01T7HX [0,0,1,0,1,0|1,0,0]=3
23  B19R1.25728  OC(=O)CCCCCNC(=O)OCc1ccccc1 1P003TCF [0,0,1,0,1,0|2,0,0]=4
24  B19R1.83743  CCCC[C@@H](C(=O)O)NC(=O)OCc1ccccc1 1P001MXO [0,0,1,0,1,0|2,0,0]=4
25  B19R1.83743  CCCC[C@H](C(=O)O)NC(=O)OCc1ccccc1 1P001MXN [0,0,1,0,1,0|2,0,0]=4
26  B19R2.3421  O=CC1CCCCN1C(=O)OCc2ccccc2 1P008SCD [1,0,0,0,1,0|2,0,0]=4
27  B19R2.8883  OC(=O)C1CCCN1C(=O)OCc2ccccc2 1P00D8IK [0,0,0,0,2,0|2,0,0]=4
28  B19R2.8883  OC(=O)[C@@H]1CCCN1C(=O)OCc2ccccc2 1P007RVX [0,0,0,0,2,0|2,0,0]=4
29  B19R2.8883  OC(=O)[C@H]1CCCN1C(=O)OCc2ccccc2 1P003BU4 [0,0,0,0,2,0|2,0,0]=4