0  B10R0.6  CC(CC(OCCOC)=O)=O M10175460P [0,0,0,0,0,0|2,0,1]=3
1  B9R0.5  O=C(OCCCC)CC#N M10076065P [1,0,0,0,0,0|1,0,1]=3
2  B11R0.165  O=C(OC(C)(C)C)NCCNC M10715703P [0,1,0,0,0,0|3,0,0]=4
3  B11R1.34  O=C1CC(CC(CCC)C1)=O M10296294P [0,0,0,1,0,0|2,0,1]=4
4  B9R0.47  CC(C(OCCCC)=O)=O M10165130P [0,0,0,0,1,0|1,0,1]=3
5  B9R0.47  C[C@H](O)C(OCCCC)=O M10223932P [0,0,0,0,1,0|1,0,0]=2
6  B11R0.46  CC(CCC(OCCCC)=O)=O M10039525P [0,0,0,0,0,1|1,0,1]=3
7  B8R0.4  CCCCNCCCC M10087124P [2,0,0,0,0,0|1,0,1]=4
8  B8R0.7  CC(C)CCCCCO M12278016P [2,0,0,0,0,0|1,0,1]=4
9  B8R0.7  CC(O)CCCCCC M10060290P [2,0,0,0,0,0|1,0,1]=4
10  B8R0.7  CC(O)COCCCC M10069007P [2,0,0,0,0,0|1,0,0]=3
11  B8R0.7  C[C@@H](O)CCCCCC M10082518P [2,0,0,0,0,0|1,0,1]=4
12  B8R0.7  C[C@H](O)CCCCCC M10084602P [2,0,0,0,0,0|1,0,1]=4
13  B8R0.1  O=C(OCC)CCCBr M10049666P [2,0,0,0,0,0|2,0,0]=4
14  B8R0.1  O=C(OCC)CCCCl M10051695P [2,0,0,0,0,0|2,0,0]=4
15  B8R0.1  O=C(OCC)CCCN M10097497P [2,0,0,0,0,0|2,0,0]=4
16  B8R0.1  O=C(OCC)COCC M10021200P [2,0,0,0,0,0|2,0,0]=4
17  B8R0.5  CC(N)CC(OCC)=O M10070569P [2,0,0,0,0,0|1,0,0]=3
18  B8R0.5  C[C@H](O)CC(OCC)=O M10290748P [2,0,0,0,0,0|1,0,0]=3
19  B8R0.6  O=C(OCCCC)CCl M10014991P [2,0,0,0,0,0|1,0,0]=3
20  B8R0.6  O=C(OCCCC)CO M10104696P [2,0,0,0,0,0|1,0,0]=3
21  B10R0.78  CCCCC(OCC(C)C)=O M10116460P [1,1,0,0,0,0|2,0,0]=4
22  B10R0.97  CC(C)CCSCCC(C)C M10013734P [1,1,0,0,0,0|0,1,1]=4
23  B10R0.28  O=C(OC(C)(C)C)CCCN M10302445P [1,1,0,0,0,0|2,0,0]=4
24  B10R0.32  CC(C)CC(C(OCC)=O)=O M10192294P [1,1,0,0,0,0|1,0,1]=4
25  B10R0.1  O=C(OCC)CCCCCO M10070500P [1,1,0,0,0,0|2,0,0]=4
26  B10R0.2  CCCC(O)CC(OCC)=O M10042346P [1,1,0,0,0,0|2,0,0]=4
27  B10R0.19  CCCCC(Br)C(OCC)=O M10016197P [1,1,0,0,0,0|2,0,0]=4
28  B10R0.19  CCCCC(C(OCC)=O)=O M10080038P [1,1,0,0,0,0|2,0,0]=4
29  B10R0.91  CCCCC(OCCCC)=O M10015063P [1,1,0,0,0,0|0,0,0]=2
30  B12R0.3  CC(C)CC(CC(CC(C)C)=O)=O M10103664P [0,2,0,0,0,0|1,0,1]=4
31  B12R0.125  O=C(OC(C)(C)C)NCCCCBr M10793728P [0,2,0,0,0,0|2,0,0]=4
32  B10R1.29  O=C1N(CCCC)CCC1 M10054808P [1,0,0,1,0,0|1,0,0]=3
33  B10R1.138  CCCC(OCC1OC1)=O M10044259P [1,0,0,1,0,0|1,0,0]=3
34  B10R1.138  CCCC(OC[C@H]1OC1)=O M10409414P [1,0,0,1,0,0|1,0,0]=3
35  B8R0.8  CC(O)C(OCCC)=O M10016208P [1,0,0,0,1,0|1,0,0]=3
36  B8R0.8  C[C@H](N)C(CCCC)=O M10784855P [1,0,0,0,1,0|1,0,0]=3
37  B8R0.8  C[C@H](O)C(OCCC)=O M10271936P [1,0,0,0,1,0|1,0,0]=3