0  B11R1.40  COC(=O)CC1CCNCC1 P12406 [0,0,0,0,0,0|3,0,1]=4
1  B11R1.40  COC(=O)CC1CCNCC1 P12406 [0,0,0,0,0,0|3,0,1]=4
2  B11R1.40  N[C@H](CO)CC1CCCCC1 A15443 [0,0,0,0,0,0|3,0,0]=3
3  B10R1.17  NCCCC1CCCNC1 P15960 [1,0,0,0,0,0|3,0,0]=4
4  B10R1.17  OCCCC1CCCCN1 P15957 [1,0,0,0,0,0|3,0,0]=4
5  B10R1.17  OCCCC1CCCNC1 P15958 [1,0,0,0,0,0|3,0,0]=4
6  B10R1.18  N=C(N)CC1CCCCC1 C16843 [1,0,0,0,0,0|1,0,1]=3
7  B12R1.32  CNCC(O)CN1CCOCC1 M14952 [0,1,0,0,0,0|3,0,0]=4
8  B12R1.43  N[C@@H](CC1CCCCC1)C(=O)O C7307 [0,1,0,0,0,0|3,0,0]=4
9  B12R2.18  NC1C(O)CC2CCCCC21 A12991 [0,0,0,1,0,0|3,0,0]=4
10  B12R2.2918  O=C1CC2(CCCCC2)CN1 P1411 [0,0,0,1,0,0|1,0,1]=3
11  B10R1.15  CCC(C)N1CCNCC1 B8150 [0,0,0,0,1,0|3,0,0]=4
12  B10R1.15  N[C@@H](CO)C1CCCCC1 A15411 [0,0,0,0,1,0|3,0,0]=4
13  B9R0.2  CCCCCCCC(=N)N O13890 [1,0,1,0,0,0|1,0,1]=4
14  B9R1.8  ClCCC1CCCCN1 C7479 [2,0,0,0,0,0|2,0,0]=4
15  B9R1.8  ClCCN1CCCCC1 C8353 [2,0,0,0,0,0|2,0,0]=4
16  B9R1.8  NCCC1=CCCCC1 C3468 [2,0,0,0,0,0|0,0,2]=4
17  B9R1.8  NCCC1CCCCN1 A13370 [2,0,0,0,0,0|1,0,0]=3
18  B9R1.8  NCCC1CCCNC1 A13371 [2,0,0,0,0,0|1,0,0]=3
19  B9R1.8  NCCC1CNCCO1 A13319 [2,0,0,0,0,0|2,0,0]=4
20  B9R1.8  NCCN1CCOCC1 A3467 [2,0,0,0,0,0|2,0,0]=4
21  B9R1.8  OCCC1CCCCN1 P6153 [2,0,0,0,0,0|2,0,0]=4
22  B9R1.8  [NH3+]CCC1CC[NH2+]CC1 A13112 [2,0,0,0,0,0|1,0,1]=4
23  B11R1.16  NC(CCO)C1CCCCC1 A14596 [1,1,0,0,0,0|2,0,0]=4
24  B11R1.91  CN(C)CCN1CCNCC1 D7452 [1,1,0,0,0,0|2,0,0]=4
25  B11R1.20  CC(C)CN1CCC(=O)CC1 I5847 [1,1,0,0,0,0|1,0,1]=4
26  B11R1.12  COC(OC)C1CCNCC1 D15015 [0,1,0,0,1,0|2,0,0]=4
27  B13R1.19  CNCC(O)CN1CCC(C)CC1 M14953 [0,2,0,0,0,0|2,0,0]=4
28  B11R2.20  C1CCC2NCCCC2C1 D3708 [1,0,0,1,0,0|2,0,0]=4
29  B11R2.10  CN1CC2CCNCC2C1 M14070 [1,0,0,1,0,0|2,0,0]=4
30  B13R3.3861  C12CC3CC(C1)C(=O)C(C2)C3 A3652 [0,0,0,2,0,0|2,0,0]=4
31  B13R3.3861  C12CC3CC(C1)C(Br)C(C2)C3 B5457 [0,0,0,2,0,0|2,0,0]=4
32  B13R3.3861  C12CC3CC(C1)C(O)C(C2)C3 A5428 [0,0,0,2,0,0|2,0,0]=4
33  B9R1.12  CCCCC1CCCN1 B15289 [1,0,0,0,1,0|2,0,0]=4
34  B9R1.6  N=C(N)C1CCCCC1 C13019 [1,0,0,0,1,0|1,0,1]=4
35  B9R1.13  CN(C)CC1CCNC1 D17027 [1,0,0,0,1,0|2,0,0]=4
36  B11R1.203  CCCCN1CCCNCC1 B7425 [1,0,0,0,0,1|2,0,0]=4