0  B20R0.112  CCCCCCCCCCCCC/C=C/[C@@H](O)[C@@H](N)CO Molport-047-352-802 [0,0,0,0,0,0|0,0,4]=4
1  B20R0.112  CCCCCCCCCCCCCC#CC(O)C(N)CO Molport-002-894-330 [0,0,0,0,0,0|0,0,4]=4
2  B19R0.153  CCCCCCCCCCCCCCOC(=O)C(C)O Molport-002-893-997 [1,0,0,0,0,0|2,0,0]=3
3  B21R0.36393  CCCCCCCCCCCCCCCC(=O)N[C@H](C)CO Molport-009-018-860 [0,0,0,0,0,1|1,0,0]=2
4  B18R0.171  CCCCCCCCCCCCCCCC(=O)NN Molport-002-507-720 [2,0,0,0,0,0|1,0,0]=3
5  B18R0.171  COC(=O)CCCCCCCCCCCCCCO Molport-003-941-668 [2,0,0,0,0,0|2,0,0]=4
6  B18R0.171  NNC(=O)CCCCCCCCCCCCCCO Molport-002-930-833 [2,0,0,0,0,0|2,0,0]=4
7  B18R0.221  CCCCCCCCCCCCCCCC#CCO Molport-002-910-711 [2,0,0,0,0,0|0,0,2]=4
8  B18R0.221  CCCCCCCCCCCCCCCCCCBr Molport-001-779-903 [2,0,0,0,0,0|1,0,1]=4
9  B18R0.221  CCCCCCCCCCCCCCCCCCN Molport-000-872-115 [2,0,0,0,0,0|1,0,1]=4
10  B20R0.2931  CCCCCCCCCCCCCCCC(=O)NC(C)C Molport-003-849-772 [1,1,0,0,0,0|2,0,0]=4
11  B20R0.32083  CCCCCC/C=C\CCCCCCCC(=O)NCCO Molport-027-641-396 [1,1,0,0,0,0|0,0,2]=4
12  B22R0.10671  CCCCCCCCCCCCCCCC(=O)NC(CO)CO Molport-009-018-678 [0,1,0,0,0,1|1,0,0]=3
13  B22R0.10671  CCCCCCCCCCCCCCCC(=O)OC(CO)CO Molport-003-983-485 [0,1,0,0,0,1|1,0,0]=3