0  B13R0.338  CCCCCCNC(=O)/C=C/OCC WXVL_AK0286SB3226 [0,0,0,0,0,0|2,0,2]=4
1  B13R0.338  CCCCCCNC(=O)/C=C/OCC WXVL_AK0286SB3226 [0,0,0,0,0,0|2,0,2]=4
2  B13R0.338  CCO/C=C/C(=O)NCCCOCC WXVL_AK0072SB3226 [0,0,0,0,0,0|3,0,1]=4
3  B13R0.338  CCO/C=C/C(=O)NCCCOCC WXVL_AK0072SB3226 [0,0,0,0,0,0|3,0,1]=4
4  B12R0.47  CCCCCNC(=O)/C=C/OCC WXVL_AK0076SB3226 [1,0,0,0,0,0|2,0,1]=4
5  B12R0.47  CCCCCNC(=O)/C=C/OCC WXVL_AK0076SB3226 [1,0,0,0,0,0|2,0,1]=4
6  B12R0.47  CCO/C=C/C(=O)NCCSCC WXVL_AK00494SB3226 [1,0,0,0,0,0|3,0,0]=4
7  B12R0.47  CCO/C=C/C(=O)NCCSCC WXVL_AK00494SB3226 [1,0,0,0,0,0|3,0,0]=4
8  B14R0.2432  CCO/C=C/C(=O)NCCC(=O)OCC WXVL_AK0465SB3226 [0,1,0,0,0,0|3,0,0]=4
9  B14R0.2432  CCO/C=C/C(=O)NCCC(=O)OCC WXVL_AK0465SB3226 [0,1,0,0,0,0|3,0,0]=4
10  B14R1.4518  CCCCCCNC(=O)C=CC1CC1 WXVL_AK0286SB4216 [0,0,0,1,0,0|1,0,2]=4
11  B14R1.4518  CCCCCCNC(=O)C=CC1CC1 WXVL_AK0286SB4216 [0,0,0,1,0,0|1,0,2]=4
12  B14R1.4518  CCOCCCNC(=O)C=CC1CC1 WXVL_AK0072SB4216 [0,0,0,1,0,0|2,0,1]=4
13  B14R1.4518  CCOCCCNC(=O)C=CC1CC1 WXVL_AK0072SB4216 [0,0,0,1,0,0|2,0,1]=4
14  B11R0.140  C=CCCNC(=O)/C=C/OCC WXVL_AK00138SB3226 [2,0,0,0,0,0|2,0,0]=4
15  B11R0.140  C=CCCNC(=O)/C=C/OCC WXVL_AK00138SB3226 [2,0,0,0,0,0|2,0,0]=4
16  B11R0.140  CC/C=C/CC(=O)NCCCC WXVL_AK00588SB0349 [2,0,0,0,0,0|1,0,1]=4
17  B11R0.140  CC/C=C/CC(=O)NCCCC WXVL_AK00588SB0349 [2,0,0,0,0,0|1,0,1]=4
18  B11R0.140  CCCCNC(=O)/C=C/OCC WXVL_AK00588SB3226 [2,0,0,0,0,0|2,0,0]=4
19  B11R0.140  CCCCNC(=O)/C=C/OCC WXVL_AK00588SB3226 [2,0,0,0,0,0|2,0,0]=4
20  B13R1.24  CCCCNC(=O)C1CC=CCC1 WXVL_AK00588SB3640 [1,0,0,1,0,0|1,0,1]=4
21  B13R1.24  CCCCNC(=O)C1CC=CCC1 WXVL_AK00588SB3640 [1,0,0,1,0,0|1,0,1]=4
22  B13R1.2917  CCCCCNC(=O)C=CC1CC1 WXVL_AK0076SB4216 [1,0,0,1,0,0|1,0,1]=4
23  B13R1.2917  CCCCCNC(=O)C=CC1CC1 WXVL_AK0076SB4216 [1,0,0,1,0,0|1,0,1]=4
24  B13R1.2917  CCSCCNC(=O)C=CC1CC1 WXVL_AK00494SB4216 [1,0,0,1,0,0|2,0,0]=4
25  B13R1.2917  CCSCCNC(=O)C=CC1CC1 WXVL_AK00494SB4216 [1,0,0,1,0,0|2,0,0]=4
26  B15R1.10436  CCOC(=O)CCNC(=O)C=CC1CC1 WXVL_AK0465SB4216 [0,1,0,1,0,0|2,0,0]=4
27  B15R1.10436  CCOC(=O)CCNC(=O)C=CC1CC1 WXVL_AK0465SB4216 [0,1,0,1,0,0|2,0,0]=4