0  B8R1.3  CC1CCC(N)CC1 ALBB-001497 [0,0,0,0,0,0|4,0,0]=4
1  B8R1.3  CC1CCC(N)CC1 ALBB-001497 [0,0,0,0,0,0|4,0,0]=4
2  B7R1.3  OC1CCSCC1 ALBB-011931 [1,0,0,0,0,0|3,0,0]=4
3  B7R0.3  CC(CO)CCCO ALBB-032482 [0,0,1,0,0,0|2,1,0]=4
4  B7R0.3  CCNCC(O)CC ALBB-026226 [0,0,1,0,0,0|3,0,0]=4
5  B7R0.6  CC(O)CNC(C)C ALBB-029018 [0,0,1,0,0,0|3,0,0]=4
6  B6R0.1  CCC(O)COC ALBB-025835 [1,0,1,0,0,0|1,1,0]=4
7  B6R0.4  CC(C)SCCCl ALBB-013218 [1,0,1,0,0,0|2,0,0]=4
8  B6R0.4  CC(C)SCCO ALBB-013392 [1,0,1,0,0,0|1,0,0]=3
9  B6R0.4  CCSCC(=O)O ALBB-004310 [1,0,1,0,0,0|0,1,1]=4
10  B6R1.2  NC1CCNC1 ALBB-005927 [1,0,0,0,1,0|2,0,0]=4
11  B6R1.2  NC1CCNC1 ALBB-005927 [1,0,0,0,1,0|2,0,0]=4
12  B6R1.2  O[C@@H]1CCNC1 ALBB-014822 [1,0,0,0,1,0|1,0,0]=3