0  B12R1.75  CCC1CCCCN1CC(=O)O BB52-9893 [0,0,0,1,0,0|1,0,0]=2
1  B12R1.125  CC1CCCCN1CCC(=O)O BB52-9456 [0,0,0,1,0,0|1,0,0]=2
2  B12R1.130  O=C(O)CCCN1CCCC1=O BB52-8544 [0,0,0,1,0,0|2,0,1]=4
3  B12R1.210  O=C(O)CN1CCCCCC1=O BB52-8073 [0,0,0,1,0,0|2,0,1]=4
4  B12R1.252  O=C(O)CCNC1=NCCCC1 BB52-7685 [0,0,0,1,0,0|2,0,1]=4
5  B12R1.255  O=C(O)CCNCC1CCCO1 BB52-9538 [0,0,0,1,0,0|2,0,0]=3
6  B12R1.255  O=C(O)CCSCC1CCCO1 BB53-0449 [0,0,0,1,0,0|2,0,0]=3
7  B12R1.255  O=C(O)CNCCN1CCCC1 BB52-9612 [0,0,0,1,0,0|2,0,0]=3
8  B12R1.255  O=C(O)CSCCN1CCCC1 BB53-0583 [0,0,0,1,0,0|2,0,0]=3
9  B11R1.86  CC(=O)CN1CCCCC1C BB52-8403 [1,0,0,1,0,0|2,0,0]=4
10  B11R1.86  CC1CCCCN1CC(=O)O BB52-8696 [1,0,0,1,0,0|1,0,0]=3
11  B11R1.86  CN1CCCCC1CC(=O)O BB52-8551 [1,0,0,1,0,0|1,0,0]=3
12  B11R1.86  CN1CCCCC1CC(=O)O BB52-8555 [1,0,0,1,0,0|1,0,0]=3
13  B11R1.172  O=C(O)CNCC1CCCO1 BB53-0552 [1,0,0,1,0,0|2,0,0]=4
14  B11R1.172  O=C(O)CSCC1CCCO1 BB53-0402 [1,0,0,1,0,0|2,0,0]=4
15  B11R1.742  CC(=O)CN1CCCCCC1 BB52-8398 [1,0,0,1,0,0|2,0,0]=4
16  B11R1.742  O=C(O)CN1CCCCCC1 BB52-5709 [1,0,0,1,0,0|1,0,0]=3
17  B11R1.17  CC1CCCCN1CCCO BB52-9079 [1,0,0,1,0,0|1,0,1]=4
18  B11R1.41  CCC1CCCCN1CCO BB52-9107 [1,0,0,1,0,0|1,0,1]=4
19  B11R1.203  OCCCN1CCCCCC1 BB52-9399 [1,0,0,1,0,0|1,0,1]=4
20  B13R1.201  CC1CCCCN1C(C)CC(=O)O BB53-1123 [0,1,0,1,0,0|1,0,0]=3
21  B13R1.593  CC(CC(=O)O)NCC1CCCO1 BB53-0622 [0,1,0,1,0,0|2,0,0]=4
22  B13R1.7456  CC(CC(=O)O)N1CCCCCC1 BB52-9063 [0,1,0,1,0,0|1,0,0]=3
23  B13R1.337  O=C(O)CNCCN1CCCCC1 BB53-0585 [0,1,0,1,0,0|1,0,0]=3
24  B13R1.337  O=C(O)CNCCN1CCOCC1 BB52-9791 [0,1,0,1,0,0|2,0,0]=4
25  B13R1.337  O=C(O)CSCCN1CCCCC1 BB53-0635 [0,1,0,1,0,0|1,0,0]=3
26  B13R1.337  O=C(O)CSCCN1CCOCC1 BB53-0606 [0,1,0,1,0,0|2,0,0]=4
27  B13R1.547  CCC(=O)N1CCCCC1C(=O)O BB53-0103 [0,1,0,1,0,0|1,0,1]=4
28  B13R1.342  O=C(O)CCCC(=O)N1CCCC1 BB52-9297 [0,1,0,1,0,0|1,0,1]=4
29  B13R1.3787  CC1CCCC(C)N1CCC(=O)O BB52-8626 [0,1,0,1,0,0|1,0,0]=3
30  B13R1.90  CCC1CCCCN1CCC(=O)O BB53-0162 [0,1,0,1,0,0|0,0,0]=2
31  B13R1.343  O=C(O)CCNCCN1CCCC1 BB53-0115 [0,1,0,1,0,0|1,0,0]=3
32  B13R1.343  O=C(O)CCSCCN1CCCC1 BB53-0589 [0,1,0,1,0,0|1,0,0]=3
33  B13R1.343  O=C(O)CNCCCN1CCCC1 BB52-9248 [0,1,0,1,0,0|1,0,0]=3
34  B13R1.380  O=C(O)CN1CCCCC1CCO BB52-8953 [0,1,0,1,0,0|1,0,0]=3
35  B13R1.528  COC(=O)CCN1CCCCC1C BB52-8633 [0,1,0,1,0,0|1,0,0]=3
36  B13R1.1711  COC(=O)CCN1CCCCCC1 BB52-8629 [0,1,0,1,0,0|1,0,0]=3
37  B13R1.89  CCC1CCCCN1C(=O)C(=O)O BB52-9738 [0,1,0,1,0,0|1,0,1]=4
38  B13R1.202  CC(CN1CCCCC1C)C(=O)O BB52-9607 [0,1,0,1,0,0|1,0,0]=3
39  B13R1.1110  CC(CNCC1CCCO1)C(=O)O BB52-8935 [0,1,0,1,0,0|2,0,0]=4
40  B13R1.1110  CC(SCCN1CCCC1)C(=O)O BB53-0584 [0,1,0,1,0,0|2,0,0]=4
41  B13R1.6192  CC(CN1CCCCCC1)C(=O)O BB52-9121 [0,1,0,1,0,0|1,0,0]=3
42  B13R1.467  CCCC(=O)N1CCC[C@H]1C(=O)O BB52-9005 [0,1,0,1,0,0|1,0,1]=4