0  B7R0.18  NC(CO)(CO)CO AC511798 [0,0,0,0,0,0|0,0,0]=0
1  B6R0.8  CC(C)(CBr)CBr AC200065 [1,0,0,0,0,0|3,0,0]=4
2  B6R0.8  CCC(C)(N)C#C AC182450 [1,0,0,0,0,0|2,0,1]=4
3  B6R0.8  CCC(C)(N)C#N AC182467 [1,0,0,0,0,0|2,0,1]=4
4  B6R0.8  NCC(F)(F)CO AC050309 [1,0,0,0,0,0|3,0,0]=4
5  B6R0.8  NCC(F)(F)CO AC060034 [1,0,0,0,0,0|3,0,0]=4
6  B8R0.36  OCC(Br)(CO)[N+]([O-])=O HY-B1217 [0,1,0,0,0,0|2,0,1]=4
7  B8R1.60  OCC1(CO)CCC1 AC010056 [0,0,0,1,0,0|2,0,0]=3
8  B5R0.3  C(C(CN)O)N LN00002764 [2,0,0,0,0,0|2,0,0]=4
9  B5R0.3  NC(CO)CO AC500076 [2,0,0,0,0,0|0,0,0]=2
10  B5R0.3  NCC(O)CN AC131522 [2,0,0,0,0,0|2,0,0]=4
11  B5R0.3  NCC(O)CO AC180224 [2,0,0,0,0,0|1,0,0]=3
12  B5R0.3  NC[C@@H](O)CO AC181109 [2,0,0,0,0,0|1,0,0]=3
13  B5R0.3  OCC(=C)CO AC511178 [2,0,0,0,0,0|0,0,2]=4
14  B5R0.3  OCC(O)CO HY-B1659 [2,0,0,0,0,0|0,0,0]=2
15  B5R0.3  OC[C@@H](O)CCl AC510842 [2,0,0,0,0,0|1,0,0]=3
16  B5R0.4  CC(C)(F)CO AC130344 [2,0,0,0,0,0|1,0,0]=3
17  B5R0.4  CC(C)(O)CN AC500020 [2,0,0,0,0,0|2,0,0]=4
18  B5R0.4  CC(C)(O)CO AC511880 [2,0,0,0,0,0|1,0,0]=3
19  B5R0.4  CC(F)(F)CO AC220122 [2,0,0,0,0,0|2,0,0]=4
20  B7R0.13  CC[C@](C)(C(=O)O)N LN01366341 [1,1,0,0,0,0|1,0,1]=4
21  B7R0.13  CC[C@](C)(N)C(O)=O AC511314 [1,1,0,0,0,0|1,0,1]=4
22  B7R1.25  CC1(CBr)COC1 AC181505 [1,0,0,1,0,0|2,0,0]=4
23  B7R1.25  CC1(CO)COC1 AC511653 [1,0,0,1,0,0|1,0,0]=3
24  B7R1.29  OCC1(CO)CC1 AC181028 [1,0,0,1,0,0|1,0,0]=3
25  B7R1.1  BrCC1CCOC1 AC220023 [1,0,0,1,0,0|2,0,0]=4
26  B7R1.1  C1CNCC1CO LN00335121 [1,0,0,1,0,0|2,0,0]=4
27  B7R1.1  C1COCC1CO LN00009482 [1,0,0,1,0,0|1,0,0]=3
28  B7R1.1  ClCC1CCOC1 AC220022 [1,0,0,1,0,0|2,0,0]=4
29  B7R1.1  ICC1CCOC1 AC220024 [1,0,0,1,0,0|2,0,0]=4
30  B7R1.1  OCC1CC=CC1 AC181767 [1,0,0,1,0,0|2,0,0]=4
31  B7R1.1  OCC1CCCC1 AC180018 [1,0,0,1,0,0|2,0,0]=4
32  B7R1.1  OCC1CCOC1 AC220020 [1,0,0,1,0,0|1,0,0]=3
33  B9R1.204  OCC1(CO)CCCC1 AC010002 [0,1,0,1,0,0|2,0,0]=4
34  B9R1.163  C1COCC1(C(=O)O)N LN00170684 [0,1,0,1,0,0|1,0,1]=4