0  B8R0.21  CC(C)(C)NCCC#N 3137-1-04 [1,0,0,0,0,0|2,0,1]=4
1  B8R0.21  CC(C)(C)OCCC#N 4137-1-Y9 [1,0,0,0,0,0|2,0,1]=4
2  B10R0.31  CC(C)(C)OC(=O)CC(=O)O 2123-1-X0 [0,1,0,0,0,0|2,0,1]=4
3  B10R0.31  C[N+](C)(C)C[C@H](O)CC(=O)[O-] 4133-1-X2 [0,1,0,0,0,0|2,0,0]=3
4  B10R0.48  CC(C)(C)CC(C)(C)N=C=S 7168-1-21 [0,1,0,0,0,0|1,1,1]=4
5  B10R1.329  CC1(C)CC(=O)CC(=O)C1 2218-1-X1 [0,0,0,1,0,0|1,0,1]=3
6  B10R1.329  CC1(C)CC(=O)NC(=O)C1 4H48-1-W2 [0,0,0,1,0,0|2,0,1]=4
7  B10R1.329  CC1=NC(C)(C)CC(C)O1 4H44-1-0B [0,0,0,1,0,0|3,0,0]=4
8  B8R0.14  CC(C)(C)C(=O)CC=O 2117-1-0H [0,0,0,0,1,0|1,0,1]=3
9  B7R0.2  CCC(C)CC(C)N 3130-5-X2 [2,0,0,0,0,0|1,0,1]=4
10  B7R0.9  CC(C)(C)CC(=O)O 2121-1-X4 [2,0,0,0,0,0|1,0,1]=4
11  B9R1.34  CC1CC(=O)CC(=O)C1 P612-A-64 [1,0,0,1,0,0|1,0,1]=4
12  B11R1.1362  CC1(C)CC(=O)CC(C)(C)N1 4H17-1-44 [0,1,0,1,0,0|1,0,0]=3
13  B11R1.1362  CC1(C)CC(=O)CC(C)(C)N1 4H17-5-11 [0,1,0,1,0,0|1,0,0]=3
14  B11R1.1362  CC1(C)CC(=O)CC(C)(C)O1 2H17-1-88 [0,1,0,1,0,0|1,0,0]=3
15  B7R0.14  CC(C)(C)[C@@H](N)CO G311-A-12 [1,0,0,0,1,0|1,0,1]=4