0  B6R0.5  CC(C)(C)CC=O SPC-v719 [1,0,0,0,0,0|2,0,0]=3
1  B6R0.5  C[Si](C)(C)CCO SPC-k286 [1,0,0,0,0,0|2,1,0]=4
2  B8R1.51  CC1(C)C[C@H](O)CN1 SPC-r279 [0,0,0,1,0,0|3,0,0]=4
3  B8R1.72  CC1(C)CNCCO1 SPC-m460 [0,0,0,1,0,0|0,0,2]=3
4  B8R1.82  COC1(CCN)CC1 SPC-v584 [0,0,0,1,0,0|2,0,0]=3
5  B5R0.4  CC(C)(F)CO SPC-t593 [2,0,0,0,0,0|2,0,0]=4
6  B5R0.4  CC(C)(O)CN SPC-g498 [2,0,0,0,0,0|0,0,1]=3
7  B5R0.4  [C-]#[N+]C(C)(C)C SPC-m995 [2,0,0,0,0,0|0,0,0]=2
8  B7R0.7  [C-]#[N+]CC(=O)OCC SPC-q003 [1,1,0,0,0,0|1,0,1]=4
9  B7R0.9  CC(C)(C)CC(=O)Cl SPC-v725 [1,1,0,0,0,0|2,0,0]=4
10  B7R0.14  CC(C)(O)[C@@H](F)CN SPC-u815 [1,1,0,0,0,0|2,0,0]=4
11  B7R1.1  CO[C@@H]1CCNC1 SPC-h272 [1,0,0,1,0,0|0,0,2]=4
12  B7R1.1  CO[C@H]1CCNC1 SPC-h271 [1,0,0,1,0,0|0,0,2]=4
13  B7R1.1  CO[C@H]1CCNC1 SPC-h273 [1,0,0,1,0,0|0,0,2]=4
14  B7R1.3  C[C@@H]1CNCCO1 SPC-n699 [1,0,0,1,0,0|0,0,2]=4
15  B7R1.3  C[C@H]1CNCCO1 SPC-m798 [1,0,0,1,0,0|0,0,2]=4
16  B7R1.6  NCC[C@H]1CCO1 SPC-s809 [1,0,0,1,0,0|2,0,0]=4
17  B7R1.6  OCC[C@H]1CCO1 SPC-t605 [1,0,0,1,0,0|2,0,0]=4
18  B7R1.10  COC1CC(=O)C1 SPC-i084 [1,0,0,1,0,0|2,0,0]=4
19  B7R1.10  COC1CC(N)C1 SPC-h655 [1,0,0,1,0,0|2,0,0]=4
20  B7R1.25  COC1(C)CNC1 SPC-i510 [1,0,0,1,0,0|0,0,2]=4
21  B7R1.14  CC1(C)CCNC1 SPC-m061 [1,0,0,1,0,0|0,0,2]=4
22  B7R1.14  C[C@@]1(O)CCNC1 SPC-n747 [1,0,0,1,0,0|0,0,2]=4
23  B7R1.14  C[C@]1(O)CCNC1 SPC-g916 [1,0,0,1,0,0|0,0,2]=4
24  B7R1.14  C[C@]1(O)CCNC1 SPC-j188 [1,0,0,1,0,0|0,0,2]=4
25  B7R1.14  C[C@]1(O)CCNC1 SPC-n763 [1,0,0,1,0,0|0,0,2]=4
26  B7R1.14  C[C@]1(O)CCNC1 SPC-s688 [1,0,0,1,0,0|0,0,2]=4
27  B7R1.16  CC1(C)CC(=O)C1 SPC-q743 [1,0,0,1,0,0|2,0,0]=4
28  B7R1.16  CC1(C)CC(N)C1 SPC-i087 [1,0,0,1,0,0|2,0,0]=4
29  B7R1.16  CC1(C)CC(O)C1 SPC-s261 [1,0,0,1,0,0|2,0,0]=4
30  B7R1.17  CC1(C)CC[C@@H]1O SPC-s189 [1,0,0,1,0,0|2,0,0]=4
31  B7R1.17  CC1(C)OCC1=O SPC-r001 [1,0,0,1,0,0|1,0,1]=4
32  B7R1.17  CC1(C)OC[C@@H]1N SPC-v294 [1,0,0,1,0,0|0,0,1]=3
33  B7R1.29  COC1(CN)CC1 SPC-u036 [1,0,0,1,0,0|0,0,1]=3
34  B9R1.133  CC1(C)C[C@H](CN)CO1 SPC-u590 [0,1,0,1,0,0|1,0,1]=4
35  B9R1.66  CC1(C)CC(=O)CCO1 SPC-s192 [0,1,0,1,0,0|1,0,1]=4
36  B9R1.175  COC1(CCO)COC1 SPC-u299 [0,1,0,1,0,0|2,0,0]=4
37  B9R1.204  COC1(OC)CCNC1 SPC-n084 [0,1,0,1,0,0|0,0,2]=4
38  B9R2.173  C1C[C@@]2(CCO2)CN1 SPC-b099 [0,0,0,2,0,0|0,0,2]=4
39  B9R2.162  COC12CC(I)(C1)C2 SPC-w152 [0,0,0,2,0,0|2,0,0]=4
40  B9R2.162  COC12CC(N)(C1)C2 SPC-o089 [0,0,0,2,0,0|2,0,0]=4
41  B9R2.174  C1COC2(CC2)CN1 SPC-u345 [0,0,0,2,0,0|0,0,2]=4