COMPND    HMDB0015352
HETATM    1  C1  UNL     1      -1.787  -2.025   0.553  1.00  0.00           C  
HETATM    2  N1  UNL     1      -0.484  -1.616   0.263  1.00  0.00           N  
HETATM    3  C2  UNL     1      -0.196  -0.227   0.048  1.00  0.00           C  
HETATM    4  C3  UNL     1       1.284  -0.236  -0.243  1.00  0.00           C  
HETATM    5  C4  UNL     1       1.878   0.282  -1.335  1.00  0.00           C  
HETATM    6  C5  UNL     1       3.288   0.245  -1.442  1.00  0.00           C  
HETATM    7  C6  UNL     1       4.007  -0.323  -0.418  1.00  0.00           C  
HETATM    8  C7  UNL     1       3.384  -0.851   0.696  1.00  0.00           C  
HETATM    9  C8  UNL     1       2.019  -0.820   0.808  1.00  0.00           C  
HETATM   10 CL1  UNL     1       1.284  -1.556   2.208  1.00  0.00          CL  
HETATM   11  C9  UNL     1      -0.957   0.214  -1.154  1.00  0.00           C  
HETATM   12  C10 UNL     1      -2.162   1.081  -0.886  1.00  0.00           C  
HETATM   13  C11 UNL     1      -1.980   2.098   0.196  1.00  0.00           C  
HETATM   14  C12 UNL     1      -1.757   1.240   1.467  1.00  0.00           C  
HETATM   15  C13 UNL     1      -0.401   0.667   1.202  1.00  0.00           C  
HETATM   16  O1  UNL     1       0.456   0.996   1.982  1.00  0.00           O  
HETATM   17  H1  UNL     1      -2.171  -1.794   1.564  1.00  0.00           H  
HETATM   18  H2  UNL     1      -2.491  -1.687  -0.231  1.00  0.00           H  
HETATM   19  H3  UNL     1      -1.852  -3.161   0.509  1.00  0.00           H  
HETATM   20  H4  UNL     1       0.096  -2.263  -0.277  1.00  0.00           H  
HETATM   21  H5  UNL     1       1.325   0.732  -2.149  1.00  0.00           H  
HETATM   22  H6  UNL     1       3.719   0.671  -2.334  1.00  0.00           H  
HETATM   23  H7  UNL     1       5.096  -0.353  -0.498  1.00  0.00           H  
HETATM   24  H8  UNL     1       4.025  -1.282   1.462  1.00  0.00           H  
HETATM   25  H9  UNL     1      -1.389  -0.684  -1.699  1.00  0.00           H  
HETATM   26  H10 UNL     1      -0.399   0.743  -1.930  1.00  0.00           H  
HETATM   27  H11 UNL     1      -2.398   1.661  -1.820  1.00  0.00           H  
HETATM   28  H12 UNL     1      -3.085   0.522  -0.662  1.00  0.00           H  
HETATM   29  H13 UNL     1      -2.898   2.691   0.274  1.00  0.00           H  
HETATM   30  H14 UNL     1      -1.069   2.678   0.032  1.00  0.00           H  
HETATM   31  H15 UNL     1      -1.807   1.842   2.379  1.00  0.00           H  
HETATM   32  H16 UNL     1      -2.576   0.518   1.435  1.00  0.00           H  
CONECT    1    2   17   18   19
CONECT    2    3   20
CONECT    3    4   11   15
CONECT    4    5    5    9
CONECT    5    6   21
CONECT    6    7    7   22
CONECT    7    8   23
CONECT    8    9    9   24
CONECT    9   10
CONECT   11   12   25   26
CONECT   12   13   27   28
CONECT   13   14   29   30
CONECT   14   15   31   32
CONECT   15   16   16
END