0  B13R1.135  COC(=O)[C@@H](N)CC1=CC=CC=C1 10882 [1,0,1,0,0,0|2,0,0]=4
1  B13R1.135  COC(=O)[C@H](N)CC1=CC=CC=C1 10883 [1,0,1,0,0,0|2,0,0]=4
2  B13R1.135  N[C@H](Cc1ccccc1)C(=O)CCl 11515 [1,0,1,0,0,0|2,0,0]=4
3  B13R1.202  CC1=C(C[C@@H](N)C(=O)O)C=CC=C1 29793 [1,0,1,0,0,0|1,0,0]=3
4  B13R1.202  CC1=C(C[C@H](N)C(=O)O)C=CC=C1 29792 [1,0,1,0,0,0|1,0,0]=3
5  B13R1.202  NC1=C(C[C@@H](N)C(=O)O)C=CC=C1 30192 [1,0,1,0,0,0|1,0,0]=3
6  B13R1.202  N[C@@H](CC1=C(Br)C=CC=C1)C(=O)O 18007 [1,0,1,0,0,0|0,1,0]=3
7  B13R1.202  N[C@@H](CC1=C(Cl)C=CC=C1)C(=O)O 11960 [1,0,1,0,0,0|0,0,0]=2
8  B13R1.202  N[C@@H](CC1=C(F)C=CC=C1)C(=O)O 29772 [1,0,1,0,0,0|0,1,0]=3
9  B13R1.202  N[C@H](CC1=C(Br)C=CC=C1)C(=O)O 17997 [1,0,1,0,0,0|0,1,0]=3
10  B13R1.202  N[C@H](CC1=C(Cl)C=CC=C1)C(=O)O 11958 [1,0,1,0,0,0|0,0,0]=2
11  B13R1.202  N[C@H](CC1=C(Cl)C=CC=C1)C(=O)O 17991 [1,0,1,0,0,0|0,0,0]=2
12  B13R1.202  N[C@H](CC1=C(F)C=CC=C1)C(=O)O 23304 [1,0,1,0,0,0|0,1,0]=3
13  B13R1.202  N[C@H](CC1=C(F)C=CC=C1)C(=O)O 29773 [1,0,1,0,0,0|0,1,0]=3
14  B13R2.5179  O=C1CCC2=C(Br)C=CC=C2C1 17236 [2,0,0,0,0,0|1,1,0]=4
15  B13R2.5179  O=C1CCC2=C(Cl)C=CC=C2C1 17936 [2,0,0,0,0,0|1,0,0]=3
16  B13R2.5179  O=C1CCC2=C(F)C=CC=C2C1 17935 [2,0,0,0,0,0|1,1,0]=4
17  B13R2.5179  O=C1CCC2=C(I)C=CC=C2C1 17938 [2,0,0,0,0,0|1,1,0]=4
18  B13R2.5179  O=C1CCC2=C(O)C=CC=C2N1 24134 [2,0,0,0,0,0|1,0,0]=3
19  B13R2.5179  O=C1COC2=C(C=CC=C2O)N1 27895 [2,0,0,0,0,0|2,0,0]=4
20  B13R2.369  NC1CC2=CC=CC=C2NC1=O 17875 [2,0,0,0,0,0|0,0,0]=2
21  B13R2.369  NC1CC2=CN=CC=C2NC1=O 17876 [2,0,0,0,0,0|1,0,0]=3
22  B13R2.369  NC1CC2=NC=CC=C2NC1=O 17874 [2,0,0,0,0,0|1,0,0]=3
23  B13R2.4856  O=C1NC2=CC=CC(Cl)=C2C1=O 13911 [1,0,0,0,1,0|1,0,1]=4