0  B15R2.17700  CCCN[C@H]1CCC2=C(C1)SC(=N2)N Z1551900340 [0,0,0,0,0,0|0,0,0]=0
1  B14R2.6400  CCCC1CCC2=C(C1)SC(=N2)N Z608062204 [1,0,0,0,0,0|0,0,0]=1
2  B14R2.6400  CCCC1CCC2=C(C1)SC(=O)N2 Z608062500 [1,0,0,0,0,0|1,0,1]=3
3  B16R2.29707  CCOC(=O)N1CCC2=C(C1)SC(=N2)N Z1509525679 [0,1,0,0,0,0|3,0,0]=4
4  B16R2.176344  CCC(=O)N[C@H]1CCC2=C(C1)SC(=N2)N Z1509472883 [0,1,0,0,0,0|0,0,1]=2
5  B16R3.335  CC1=NC2=C(N1)[C@H]3CCCN[C@H]3CC2 Z3072406985 [0,0,0,1,0,0|2,0,0]=3
6  B16R3.206774  NC1=NC2=C(S1)CC3(CC2)OCCO3 Z1416194243 [0,0,0,1,0,0|2,0,0]=3
7  B13R2.2121  CCC1CCC2=C(C1)SC(=N2)N Z594038180 [2,0,0,0,0,0|0,0,0]=2
8  B13R2.2121  CCC1CCC2=C(C1)SC(=O)N2 Z409413394 [2,0,0,0,0,0|1,0,1]=4
9  B13R2.2121  CCN1CCC2=C(C1)SC(=N2)N Z56970974 [2,0,0,0,0,0|1,0,0]=3
10  B15R2.2123  CCCCNC1CCC2=C(C1)SC=N2 Z1509175686 [1,1,0,0,0,0|0,0,0]=2
11  B15R3.1739  C1=NC2=C(N1)CCC3C2CCCN3 Z3038802635 [1,0,0,1,0,0|1,0,1]=4
12  B17R3.458965  NC1=NC2=C(S1)CC3(CCOCC3)CC2 Z2235606791 [0,1,0,1,0,0|1,0,0]=3