COMPND    HMDB0257459
HETATM    1  O1  UNL     1      -0.432   1.236   1.295  1.00  0.00           O  
HETATM    2  C1  UNL     1       0.277   0.486   0.352  1.00  0.00           C  
HETATM    3  N1  UNL     1      -0.255  -0.497  -0.258  1.00  0.00           N  
HETATM    4  C2  UNL     1      -1.582  -0.954  -0.078  1.00  0.00           C  
HETATM    5  C3  UNL     1      -1.886  -2.137   0.563  1.00  0.00           C  
HETATM    6  C4  UNL     1      -3.191  -2.557   0.723  1.00  0.00           C  
HETATM    7  C5  UNL     1      -4.258  -1.820   0.254  1.00  0.00           C  
HETATM    8  C6  UNL     1      -3.959  -0.637  -0.388  1.00  0.00           C  
HETATM    9  C7  UNL     1      -2.653  -0.219  -0.547  1.00  0.00           C  
HETATM   10  C8  UNL     1       1.647   0.850   0.074  1.00  0.00           C  
HETATM   11  C9  UNL     1       2.180   1.930   0.765  1.00  0.00           C  
HETATM   12  C10 UNL     1       3.480   2.325   0.544  1.00  0.00           C  
HETATM   13  C11 UNL     1       4.289   1.676  -0.357  1.00  0.00           C  
HETATM   14  C12 UNL     1       3.783   0.612  -1.047  1.00  0.00           C  
HETATM   15  C13 UNL     1       2.447   0.198  -0.827  1.00  0.00           C  
HETATM   16  O2  UNL     1       2.008  -0.869  -1.548  1.00  0.00           O  
HETATM   17  H1  UNL     1      -1.232   1.790   1.078  1.00  0.00           H  
HETATM   18  H2  UNL     1      -1.044  -2.711   0.929  1.00  0.00           H  
HETATM   19  H3  UNL     1      -3.402  -3.501   1.237  1.00  0.00           H  
HETATM   20  H4  UNL     1      -5.271  -2.174   0.394  1.00  0.00           H  
HETATM   21  H5  UNL     1      -4.809  -0.065  -0.753  1.00  0.00           H  
HETATM   22  H6  UNL     1      -2.462   0.722  -1.060  1.00  0.00           H  
HETATM   23  H7  UNL     1       1.558   2.468   1.492  1.00  0.00           H  
HETATM   24  H8  UNL     1       3.855   3.170   1.104  1.00  0.00           H  
HETATM   25  H9  UNL     1       5.312   1.988  -0.531  1.00  0.00           H  
HETATM   26  H10 UNL     1       4.392   0.077  -1.765  1.00  0.00           H  
HETATM   27  H11 UNL     1       1.206  -1.387  -1.645  1.00  0.00           H  
CONECT    1    2   17
CONECT    2    3    3   10
CONECT    3    4
CONECT    4    5    5    9
CONECT    5    6   18
CONECT    6    7    7   19
CONECT    7    8   20
CONECT    8    9    9   21
CONECT    9   22
CONECT   10   11   11   15
CONECT   11   12   23
CONECT   12   13   13   24
CONECT   13   14   25
CONECT   14   15   15   26
CONECT   15   16
CONECT   16   27
END