0  B12R2.766  CC1=CC(=O)C2CC1C2(C)C Molport-000-706-765 [0,0,0,0,0,0|0,0,0]=0
1  B11R1.166  CC(C)[C@@H]1CC[C@@H](CC1=O)C Molport-006-122-567 [0,0,1,0,0,0|0,0,2]=3
2  B11R1.166  CC(C)[C@H]1CC[C@H](CC1=O)C Molport-002-536-745 [0,0,1,0,0,0|0,0,2]=3
3  B11R1.166  CC1=CC(=NCN1C(C)C)N Molport-017-271-723 [0,0,1,0,0,0|3,0,0]=4
4  B11R1.325  CC1=C(C(NC(=O)S1)(C)C)C Molport-002-549-979 [0,0,1,0,0,0|2,0,1]=4
5  B11R2.613  CC1(C2C1C(=O)OC2=O)C Molport-006-067-881 [0,0,0,0,1,0|2,0,0]=3
6  B13R2.7100  CC1CC(=O)NC2CC1C2(C)C Molport-046-067-651 [0,0,0,0,0,1|0,0,2]=3
7  B10R1.13  C=C1C=CC(CC1)C(C)C Molport-006-111-816 [1,0,1,0,0,0|0,0,1]=3
8  B10R1.13  CC1=CCC(C=C1)C(C)C Molport-003-960-040 [1,0,1,0,0,0|0,0,1]=3
9  B10R1.329  CC1(CC(=CC(=O)N1)O)C Molport-046-069-631 [1,0,1,0,0,0|2,0,0]=4
10  B10R1.329  CC1(CC(=O)C=C(C1)Cl)C Molport-001-768-051 [1,0,1,0,0,0|1,0,0]=3
11  B10R1.329  CC1(CC(=O)C=C(C1)Cl)C Molport-009-760-711 [1,0,1,0,0,0|1,0,0]=3
12  B10R1.329  CC1(CC(=O)C=C(C1)N)C Molport-000-742-541 [1,0,1,0,0,0|1,0,0]=3
13  B10R1.329  CC1=CC(=O)OC(O1)(C)C Molport-003-928-476 [1,0,1,0,0,0|2,0,0]=4
14  B10R1.329  CC1CC(=O)CC(C1)(C)C Molport-001-793-291 [1,0,1,0,0,0|0,0,2]=4
15  B14R2.27718  CC1([C@@H]2CC[C@]1(C(=O)OC2=O)C)C Molport-029-657-440 [0,1,0,0,0,1|2,0,0]=4
16  B14R2.27718  CC12CCC(C1(C)C)C(=O)NC2=O Molport-000-208-145 [0,1,0,0,0,1|2,0,0]=4
17  B14R2.27718  CC12CCC(C1(C)C)C(=O)OC2=O Molport-001-763-796 [0,1,0,0,0,1|2,0,0]=4