0  B14R2.19  NC1=NN(CC2=CC=CC=C2)C=C1 32089 [1,0,0,0,0,0|2,0,1]=4
1  B14R2.19  O=C1N[C@@H](CC2=CC=CC=C2)CO1 6915 [1,0,0,0,0,0|1,0,1]=3
2  B14R2.19  O=C1N[C@H](CC2=CC=CC=C2)CO1 6916 [1,0,0,0,0,0|1,0,1]=3
3  B14R2.19  S=C1N[C@H](CC2=CC=CC=C2)CS1 35899 [1,0,0,0,0,0|1,1,1]=4
4  B16R2.316  NC1=NN(CC2=C(Cl)C=C(F)C=C2)C=C1 22714 [0,1,0,0,0,0|2,0,1]=4
5  B14R1.337  N[C@@H](CC(=O)O)Cc1ccccc1Cl 30110 [0,0,1,0,0,0|3,0,0]=4
6  B14R1.337  N[C@H](CC(=O)O)Cc1ccccc1Cl 30082 [0,0,1,0,0,0|3,0,0]=4
7  B14R2.256  NC1=CC(C2=C(Cl)C=CC=C2)=NO1 15542 [0,0,0,0,1,0|2,0,1]=4
8  B15R2.98  NC1=CC=C(C[C@H]2COC(=O)N2)C=C1 7548 [1,1,0,0,0,0|1,0,1]=4
9  B13R1.202  N[C@@H](CC1=C(Cl)C=CC=C1)C(=O)O 11960 [0,0,1,0,1,0|2,0,0]=4
10  B13R1.202  N[C@H](CC1=C(Cl)C=CC=C1)C(=O)O 11958 [0,0,1,0,1,0|2,0,0]=4
11  B13R1.202  N[C@H](CC1=C(Cl)C=CC=C1)C(=O)O 17991 [0,0,1,0,1,0|2,0,0]=4
12  B13R1.528  COC(=O)CCC1=C(Br)C=CC=C1 28882 [0,0,1,0,1,0|1,1,0]=4
13  B13R2.10  NC1=NC(C2=CC=CC=C2)=CO1 27480 [1,0,0,0,1,0|0,0,2]=4
14  B13R2.10  NC1=NN(C2=CC=CC=C2)CC1 22707 [1,0,0,0,1,0|2,0,0]=4
15  B13R2.10  O=C1N[C@@H](c2ccccc2)CO1 6076 [1,0,0,0,1,0|1,0,1]=4
16  B13R2.10  O=C1N[C@H](c2ccccc2)CO1 6077 [1,0,0,0,1,0|1,0,1]=4