0  B8R1.7  O=C(O)C1CSCN1 D08601 [0,1,0,0,0,0|2,0,1]=4
1  B8R1.7  O=C(O)[C@@H]1CCCN1 D00035 [0,1,0,0,0,0|1,0,1]=3
2  B6R0.6  OCCNCCO D02337 [0,0,1,0,0,0|1,0,0]=2
3  B5R0.1  CC(O)CCO D10695 [1,0,1,0,0,0|1,0,0]=3
4  B5R0.1  CC(O)C[197Hg]O D04940 [1,0,1,0,0,0|2,0,0]=4
5  B5R0.1  CCOC(C)=O D02319 [1,0,1,0,0,0|0,0,2]=4
6  B5R0.3  OCC(O)CO D00028 [1,0,1,0,0,0|1,0,0]=3
7  B5R0.3  OCC(O)CS D05075 [1,0,1,0,0,0|1,0,0]=3
8  B5R0.3  OCC(S)CS D00167 [1,0,1,0,0,0|1,1,0]=4
9  B7R0.10  OC[C@H](O)[C@H](O)CO D08915 [0,1,1,0,0,0|1,0,0]=3
10  B7R0.12  [*]OCC(CO)O[*] D05073 [0,1,1,0,0,0|2,0,0]=4
11  B7R0.4  CCCCCC(C)N D07371 [0,1,1,0,0,0|2,0,0]=4
12  B7R1.2  CC1COC(=O)O1 D05633 [1,1,0,0,0,0|1,0,1]=4
13  B9R1.21  OCC1COC(CI)O1 D03888 [0,2,0,0,0,0|1,0,0]=3
14  B5R1.2  O=C1CCO1 D05630 [1,0,0,0,1,0|0,0,2]=4
15  B5R1.3  ClCC1CO1 D01983 [0,0,0,0,2,0|1,0,0]=3
16  B5R1.3  ClCC1CO1 D08512 [0,0,0,0,2,0|1,0,0]=3