COMPND    HMDB0033135
HETATM    1  C1  UNL     1      -2.400   2.076   1.044  1.00  0.00           C  
HETATM    2  C2  UNL     1      -1.993   0.836   0.349  1.00  0.00           C  
HETATM    3  C3  UNL     1      -2.994   0.042  -0.204  1.00  0.00           C  
HETATM    4  C4  UNL     1      -2.593  -1.116  -0.851  1.00  0.00           C  
HETATM    5  C5  UNL     1      -3.654  -1.983  -1.453  1.00  0.00           C  
HETATM    6  N1  UNL     1      -1.318  -1.469  -0.949  1.00  0.00           N  
HETATM    7  C6  UNL     1      -0.362  -0.671  -0.398  1.00  0.00           C  
HETATM    8  N2  UNL     1       0.967  -1.107  -0.563  1.00  0.00           N  
HETATM    9  C7  UNL     1       2.059  -0.397  -0.036  1.00  0.00           C  
HETATM   10  C8  UNL     1       1.966   0.518   0.970  1.00  0.00           C  
HETATM   11  C9  UNL     1       3.098   1.195   1.414  1.00  0.00           C  
HETATM   12  C10 UNL     1       4.322   0.946   0.841  1.00  0.00           C  
HETATM   13  C11 UNL     1       4.388   0.015  -0.174  1.00  0.00           C  
HETATM   14  C12 UNL     1       3.292  -0.665  -0.630  1.00  0.00           C  
HETATM   15  N3  UNL     1      -0.729   0.442   0.226  1.00  0.00           N  
HETATM   16  H1  UNL     1      -3.032   1.800   1.932  1.00  0.00           H  
HETATM   17  H2  UNL     1      -1.494   2.614   1.365  1.00  0.00           H  
HETATM   18  H3  UNL     1      -3.031   2.666   0.354  1.00  0.00           H  
HETATM   19  H4  UNL     1      -4.041   0.290  -0.148  1.00  0.00           H  
HETATM   20  H5  UNL     1      -3.992  -1.489  -2.381  1.00  0.00           H  
HETATM   21  H6  UNL     1      -4.460  -2.105  -0.699  1.00  0.00           H  
HETATM   22  H7  UNL     1      -3.212  -2.985  -1.689  1.00  0.00           H  
HETATM   23  H8  UNL     1       1.147  -2.007  -1.102  1.00  0.00           H  
HETATM   24  H9  UNL     1       1.042   0.758   1.481  1.00  0.00           H  
HETATM   25  H10 UNL     1       3.027   1.931   2.221  1.00  0.00           H  
HETATM   26  H11 UNL     1       5.243   1.439   1.141  1.00  0.00           H  
HETATM   27  H12 UNL     1       5.351  -0.189  -0.632  1.00  0.00           H  
HETATM   28  H13 UNL     1       3.405  -1.383  -1.429  1.00  0.00           H  
CONECT    1    2   16   17   18
CONECT    2    3    3   15
CONECT    3    4   19
CONECT    4    5    6    6
CONECT    5   20   21   22
CONECT    6    7
CONECT    7    8   15   15
CONECT    8    9   23
CONECT    9   10   10   14
CONECT   10   11   24
CONECT   11   12   12   25
CONECT   12   13   26
CONECT   13   14   14   27
CONECT   14   28
END