0  B14R1.3332  CC(C)(C)c1cnc(cn1)C(C)(C)C Molport-005-933-715 [2,0,0,0,0,0|2,0,0]=4
1  B18R1.153986  CCC(C)(C)c1cc(c(cc1O)C(C)(C)CC)O Molport-001-793-805 [0,2,0,0,0,0|0,0,0]=2
2  B16R1.23783  CC(C)(C)C1=CC(=C)C=C(C1=O)C(C)(C)C Molport-019-879-284 [0,0,0,0,1,1|1,0,1]=4