0  B14R2.8188  N[C@H]1Cc2ccccc2N(O)C1=O T24617 [0,0,0,0,0,0|0,0,0]=0
1  B13R2.369  CN1Cc2ccccc2NC1=O T50006 [1,0,0,0,0,0|2,0,0]=3
2  B13R2.369  Cc1cc2ccccc2[nH]c1=O T50035 [1,0,0,0,0,0|1,0,2]=4
3  B13R2.369  Nc1cc2ccccc2oc1=O TN1243 [1,0,0,0,0,0|1,0,2]=4
4  B13R2.369  O=c1[nH]c2ccccc2[nH]c1=O T20436 [1,0,0,0,0,0|2,0,1]=4
5  B12R1.27  COC(=O)CCc1ccccc1 T9513 [1,0,1,0,0,0|2,0,0]=4
6  B12R1.43  C(=O)([C@H](N)Cc1ccccc1)O T0689 [1,0,1,0,0,0|0,0,0]=2
7  B12R1.43  N[C@@H](Cc1ccccc1)C(O)=O TN1592 [1,0,1,0,0,0|0,0,0]=2
8  B12R1.43  OC(=O)C(=O)Cc1ccccc1 T5251 [1,0,1,0,0,0|1,0,1]=4
9  B12R1.43  OC(Cc1ccccc1)C(O)=O T4455 [1,0,1,0,0,0|1,0,0]=3
10  B12R1.43  O[C@@H](Cc1ccccc1)C(O)=O T5290 [1,0,1,0,0,0|1,0,0]=3
11  B12R1.43  O[C@H](Cc1ccccc1)C(O)=O T5274 [1,0,1,0,0,0|1,0,0]=3
12  B12R1.43  [15NH2][C@@H](CC1=CC=CC=C1)C(O)=O T40376 [1,0,1,0,0,0|0,0,0]=2
13  B12R1.43  c1ccc(cc1)C[C@@H](C(=O)O)N T3377 [1,0,1,0,0,0|0,0,0]=2
14  B12R1.169  NCCc1ccccc1CC=C T25047 [1,0,1,0,0,0|2,0,0]=4
15  B12R2.24  CC1CCc2ccccc2N1 T20448 [2,0,0,0,0,0|1,0,1]=4
16  B12R2.24  O=C1CCc2ccccc2C1 T0660 [2,0,0,0,0,0|1,0,0]=3
17  B12R2.24  O=C1CCc2ccccc2O1 T2S0300 [2,0,0,0,0,0|1,0,0]=3
18  B12R2.1081  O[C@H]1CCCC2=C1C=CC=C2 T19999 [2,0,0,0,0,0|1,0,1]=4
19  B14R1.134  COC(=O)[C@@H](N)Cc1ccc(Cl)cc1 T41143 [0,1,1,0,0,0|2,0,0]=4
20  B14R2.8239  CN1Cc2cc(Br)ccc2NC1=O T8609 [1,1,0,0,0,0|2,0,0]=4
21  B14R2.8239  OC1Oc2cc(O)ccc2NC1=O TN2744 [1,1,0,0,0,0|2,0,0]=4
22  B16R2.197061  COc1ccc2N(O)C(=O)C(O)Oc2c1 T22308 [0,2,0,0,0,0|2,0,0]=4