0  B18R3.570036  [NH2+]=C1C=CC2=NC3=C(C=C(N)C=C3)SC2=C1 M12277903P [0,0,0,0,0,0|2,0,1]=3
1  B18R3.570036  [O-]C1=CC=2OC3=CC(C=CC3=NC2C=C1)=O M10225702P [0,0,0,0,0,0|4,0,0]=4
2  B17R3.3205  ClC1=CC=C2C=C3C=CC=CC3=CC2=C1 M10147468P [1,0,0,0,0,0|2,0,0]=3
3  B17R3.30284  BrC1=CC=C2C3=CC=C(Br)C=C3SC2=C1 M10493722P [0,0,0,0,1,0|3,0,0]=4
4  B17R3.30284  IC1=CC2=C(C=C1)C3=C(C=C(Br)C=C3)C2 M10717092P [0,0,0,0,1,0|3,0,0]=4
5  B17R3.30284  IC1=CC2=C(C=C1)C3=C(C=C(I)C=C3)C2 M10141419P [0,0,0,0,1,0|3,0,0]=4
6  B17R3.30284  NC1=CC=2CC3=C(C=CC(Br)=C3)C2C=C1 M10094850P [0,0,0,0,1,0|2,0,0]=3
7  B17R3.31627  BrC1=CC=C2C(C3=CC(Br)=CC=C3S2)=C1 M10188949P [0,0,0,0,1,0|3,0,0]=4
8  B17R3.31627  BrC1=CC=C2OC3=CC=C(Br)C=C3C2=C1 M10111213P [0,0,0,0,1,0|3,0,0]=4
9  B16R2.33  NC1=CC=C(NC2=CC=C(N)C=C2)C=C1 M10013528P [1,0,1,0,0,0|1,0,0]=3
10  B16R2.33  NC1=CC=C(OC2=CC=C(C)C=C2)C=C1 M10245465P [1,0,1,0,0,0|2,0,0]=4
11  B16R2.33  NC1=CC=C(SC2=CC=C(Cl)C=C2)C=C1 M10217793P [1,0,1,0,0,0|2,0,0]=4
12  B16R2.1129  NC1=CC=CC=C1CC2=CC=C(N)C=C2 M10029282P [1,0,1,0,0,0|0,0,2]=4
13  B16R3.1720  C12=CC=CC=C1CC3=C(C=CC=C3)N2 M10002173P [2,0,0,0,0,0|0,0,2]=4
14  B16R3.1720  C12=CC=CC=C1OC3=CC=CC=C3O2 M10006984P [2,0,0,0,0,0|2,0,0]=4
15  B16R3.1720  C12=NC3=CC=CC=C3C=C1C=CC=C2 M10006950P [2,0,0,0,0,0|0,0,0]=2
16  B16R3.1720  C=12CC3=C(C=CC=C3)OC1C=CC=C2 M10002175P [2,0,0,0,0,0|1,0,1]=4
17  B18R3.567779  BrC1=CC2=CC3=CC=C(Br)C=C3C=C2C=C1 M10815544P [1,1,0,0,0,0|2,0,0]=4
18  B16R3.2583  BrC1=CC=C2C(C3=CC=CC=C3S2)=C1 M10175197P [1,0,0,0,1,0|2,0,0]=4
19  B16R3.2583  BrC1=CC=C2OC3=CC=CC=C3C2=C1 M10001711P [1,0,0,0,1,0|2,0,0]=4
20  B16R3.2637  BrC1=CC=2NC3=C(C=CC=C3)C2C=C1 M10056445P [1,0,0,0,1,0|1,0,1]=4
21  B16R3.2637  BrC1=CC=C2C(OC3=CC=CC=C23)=C1 M10194654P [1,0,0,0,1,0|2,0,0]=4