0  B12R2.509  CC1(C)C(=O)[C@@]2(C)CC[C@@H]1C2 T7956 [0,0,0,0,0,0|0,0,0]=0
1  B12R2.509  CC1(C)C(=O)[C@]2(C)CC[C@H]1C2 TN1641 [0,0,0,0,0,0|0,0,0]=0
2  B12R2.509  CC12CCC(C1)C(C)(C)C2O T5620 [0,0,0,0,0,0|0,0,2]=2
3  B11R1.1322  CC1(C)CCCC(C)(C)N1[O] T5363 [0,0,1,0,0,0|1,0,1]=3
4  B11R1.1322  CN1C(C)(C)CCCC1(C)C T0296 [0,0,1,0,0,0|2,0,0]=3
5  B12R1.3856  C=CC1(C)CCC(C(C)(C)O)O1 T8014 [0,1,1,0,0,0|2,0,0]=4
6  B12R1.510  CC1(C)CC(O)CC(C)(C)N1[O] T6699 [0,1,1,0,0,0|1,0,1]=4