0  B20R3.4308849  CC1=CC2=C(C(=O)C3=CC=CC=C3C2=O)C(Br)=C1 11639 [0,1,0,0,0,0|2,0,0]=3
1  B20R3.4308849  CC1=CC2=C(C(=O)C3=CC=CC=C3C2=O)C(N)=C1 11638 [0,1,0,0,0,0|2,0,0]=3
2  B18R2.12620  CC1=CC(C)=C(N)C(C(O)C2=CC=CC=C2)=C1 13690 [0,0,1,0,0,0|0,0,2]=3
3  B18R2.12620  NC1=C(C(=O)C2=CC=CC=C2)C=C(Br)C=C1Br 10709 [0,0,1,0,0,0|2,0,0]=3
4  B17R3.35227  O=C1C2=C(C=CC=C2)OC3=C1C=CC=N3 1317 [2,0,0,0,0,0|2,0,0]=4
5  B17R3.35227  O=C1C2=C(C=CC=C2)SC3=C1C=CC=N3 1316 [2,0,0,0,0,0|2,0,0]=4
6  B17R3.35227  O=C1C2=CC=CC=C2C=C3C=CC=CN13 16279 [2,0,0,0,0,0|2,0,0]=4
7  B17R3.35227  O=C1C2=CC=CC=C2SC3=C1C=CC=C3 13652 [2,0,0,0,0,0|1,0,0]=3
8  B17R3.35227  O=C1C2=CC=CC=C2[Te]C3=C1C=CC=C3 13651 [2,0,0,0,0,0|1,0,0]=3
9  B17R3.3205  NC1=CC2=CC3=CC=CC=C3C=C2C=C1 10999 [2,0,0,0,0,0|2,0,0]=4
10  B19R3.152782  NC1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O 18998 [1,1,0,0,0,0|2,0,0]=4
11  B19R3.169429  CC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O 11636 [1,1,0,0,0,0|1,0,0]=3
12  B19R3.2936359  CC1=CC(C)=C2C(=O)N3C=CC=CC3=CC2=C1 16284 [1,1,0,0,0,0|2,0,0]=4
13  B21R3.6564131  CC1=C(Cl)C2=C(C(=O)C3=CC=CC=C3C2=O)C(Cl)=C1 11641 [0,2,0,0,0,0|2,0,0]=4
14  B21R3.6564131  CC1=C(I)C2=C(C(=O)C3=CC=CC=C3C2=O)C(Br)=C1 11642 [0,2,0,0,0,0|2,0,0]=4
15  B21R3.12286501  CC1=C(C)C(C)=C2C(=O)N3C=CC=CC3=CC2=C1C 16278 [0,2,0,0,0,0|2,0,0]=4
16  B19R3.87160  CC1=CC2=C(C=C1)NC3=NC=CC=C3C(=O)N2 19098 [0,0,1,1,0,0|2,0,0]=4