0  B16R3.3329  CC1NCCC2=C1NC3=CC=CC=C32 SBB007400 [0,0,0,0,0,0|3,0,0]=3
1  B16R3.3329  NC1CCCC2=C1NC3=C2C=CC=C3 SBB018720 [0,0,0,0,0,0|3,0,0]=3
2  B16R3.3329  O=C1CCCC2=C1NC3=C2C=CC=C3 SBB012615 [0,0,0,0,0,0|3,0,1]=4
3  B16R3.3329  OC1CCCC2=C1NC3=CC=CC=C32 SBB013831 [0,0,0,0,0,0|3,0,0]=3
4  B15R3.3  C1=CC2=C(C=C1)C3=C(CCCC3)N2 SBB003845 [1,0,0,0,0,0|2,0,0]=3
5  B15R3.3  C1=CC2=C(C=C1)C3=C(CCNC3)N2 SBB004411 [1,0,0,0,0,0|1,0,0]=2
6  B15R3.3  C1=CC=C2C(=C1)NC3=C2CCNC3 SBB048967 [1,0,0,0,0,0|3,0,0]=4
7  B17R3.633  N#CC1CCCC2=C1NC3=CC=CC=C32 SBB014245 [0,1,0,0,0,0|2,0,1]=4
8  B17R3.633  NCC1CCCC2=C1NC3=C2C=CC=C3 SBB018805 [0,1,0,0,0,0|2,0,0]=3
9  B17R3.284867  NC1CCCC2=C1NC3=C2C=C(Cl)C=C3 SBB019230 [0,1,0,0,0,0|3,0,0]=4
10  B17R3.284867  OC1CCCC2=C1NC3=C2C=C(Cl)C=C3 SBB014467 [0,1,0,0,0,0|3,0,0]=4
11  B17R3.284867  OC1CCCC2=C1NC3=CC=C(Br)C=C32 SBB014283 [0,1,0,0,0,0|3,0,0]=4
12  B15R2.1592  CC1=C(C(=O)NN)OC2=C1C=CC=C2 SBB076270 [0,0,1,0,0,0|2,0,1]=4
13  B14R2.1129  CCC1=C(C=O)C2=C(C=CC=C2)O1 SBB088909 [1,0,1,0,0,0|1,0,1]=4
14  B14R2.44  CN1C(CCN)=NC2=C1C=CC=C2 SBB010582 [1,0,1,0,0,0|2,0,0]=4
15  B14R2.450  CC(=O)C1=C(N)C2=CC=CC=C2O1 SBB050486 [1,0,1,0,0,0|1,0,1]=4
16  B16R3.2583  BrC1=CC2=C(C=C1)NC3=C2CCCC3 SBB005339 [1,1,0,0,0,0|2,0,0]=4
17  B16R3.2583  CC1=CC2=C(C=C1)NC3=C2CCCC3 SBB005336 [1,1,0,0,0,0|2,0,0]=4
18  B16R3.2583  CC1=CC2=C(C=C1)NC3=C2CNCC3 SBB004412 [1,1,0,0,0,0|1,0,0]=3
19  B16R3.2583  CC1CCC2=C(C1)C3=CC=CC=C3N2 SBB076432 [1,1,0,0,0,0|2,0,0]=4
20  B16R3.2583  CN1CCC2=C(C1)C3=CC=CC=C3N2 SBB048963 [1,1,0,0,0,0|1,0,0]=3
21  B16R3.2583  ClC1=CC2=C(C=C1)NC3=C2CNCC3 SBB004415 [1,1,0,0,0,0|1,0,0]=3
22  B16R3.2583  ClC1=CC=C2NC3=C(CCCC3)C2=C1 SBB044917 [1,1,0,0,0,0|2,0,0]=4
23  B16R3.2583  NC1=CC2=C(C=C1)OC3=C2CCCC3 SBB002594 [1,1,0,0,0,0|1,0,0]=3
24  B16R3.2583  NC1=CC=C2NC3=C(CCCC3)C2=C1 SBB018621 [1,1,0,0,0,0|2,0,0]=4
25  B16R3.2583  OC1=CC2=C(C=C1)OC3=C2CCCC3 SBB009986 [1,1,0,0,0,0|1,0,0]=3
26  B18R3.152976  NCC1CCCC2=C1NC3=C2C=C(Cl)C=C3 SBB019113 [0,2,0,0,0,0|2,0,0]=4
27  B16R3.1722  C1=CC2=C(C=C1)C3=C(CCCCC3)N2 SBB079698 [0,0,1,1,0,0|2,0,0]=4
28  B14R3.49  C1=CC2=C(C=C1)C3=C(CCC3)N2 SBB049783 [1,0,0,0,1,0|1,0,0]=3