0  B13R2.435  C1=CC=C2C(=C1)NC(=N2)[N+](=O)[O-] 97234 [0,0,0,0,0,0|2,0,1]=3
1  B12R2.32  CCC1=NC2=CC=CC=C2N1 15807 [1,0,0,0,0,0|2,0,1]=4
2  B14R2.450  CC(=O)C1=C(C2=CC=CC=C2O1)N 654095 [0,1,0,0,0,0|2,0,0]=3
3  B14R2.450  C[C@H](C1=NC2=CC=CC=C2N1N)O 824892 [0,1,0,0,0,0|2,0,1]=4
4  B14R2.972  COC(=O)C1=NC2=CC=CC=C2S1 902252 [0,1,0,0,0,0|1,0,1]=3
5  B14R2.4529  C1=CC2=C(C=C1Cl)C=C(N2)C(=O)O 82693 [0,1,0,0,0,0|0,0,0]=1
6  B13R1.133  C1=CC(=CC=C1C[C@@H](C(=O)O)N)F 16213123 [0,1,1,0,0,0|0,0,2]=4
7  B13R1.90  CC(=O)\C=C\C1=CC=CC=C1OC 852762 [0,1,1,0,0,0|2,0,0]=4
8  B15R2.629  CC(=O)N=C1N(C2=CC=CC=C2S1)C 656374 [0,1,0,0,0,1|2,0,0]=4
9  B15R2.984  CC1=NC2=CC=CC=C2C=C1C(=O)O 1481999 [0,1,0,0,0,1|0,0,1]=3
10  B15R2.1601  COC(=O)C1=NC2=CC=CC=C2C=C1 421738 [0,1,0,0,0,1|0,0,1]=3
11  B15R2.7174  C1=CC2=NC=C(N=C2C=C1Cl)C(=O)O 282542 [0,1,0,0,0,1|0,0,1]=3
12  B15R2.14951  CC1=NC(=NC2=CC=CC=C12)C(=O)N 224588 [0,1,0,0,0,1|1,0,1]=4
13  B15R2.630  CN1C2=CC=CC=C2N=C1S(=O)(=O)O 2724788 [0,2,0,0,0,0|2,0,0]=4
14  B15R2.1592  COC(=O)C1=C(N2C=CC=CC2=N1)F 717824 [0,2,0,0,0,0|1,0,1]=4
15  B15R2.13463  CC1=C(OC2=C1C=CC=C2F)C(=O)O 2560313 [0,2,0,0,0,0|1,0,0]=3
16  B11R1.36  C1=CC=C(C=C1)[C@@H](C(=O)O)O 439616 [0,0,1,0,1,0|1,0,1]=4
17  B11R1.90  CC1=C(SC=C1)\C=C\C(=O)O 1485238 [0,0,1,0,1,0|2,0,0]=4
18  B15R2.1660  C1=CC=C2C(=C1)N=C(S2)SCC(=O)O 80525 [0,0,0,0,0,2|1,0,1]=4