COMPND    HMDB0032127
HETATM    1 CL1  UNL     1      -4.839   1.851   1.794  1.00  0.00          CL  
HETATM    2  C1  UNL     1      -3.451   1.079   1.030  1.00  0.00           C  
HETATM    3  C2  UNL     1      -2.591   0.289   1.758  1.00  0.00           C  
HETATM    4  C3  UNL     1      -1.504  -0.311   1.146  1.00  0.00           C  
HETATM    5  C4  UNL     1      -1.221  -0.161  -0.201  1.00  0.00           C  
HETATM    6  C5  UNL     1      -0.064  -0.810  -0.867  1.00  0.00           C  
HETATM    7  C6  UNL     1       1.203  -0.214  -0.381  1.00  0.00           C  
HETATM    8  C7  UNL     1       1.681   0.917  -1.005  1.00  0.00           C  
HETATM    9  C8  UNL     1       2.855   1.522  -0.602  1.00  0.00           C  
HETATM   10  C9  UNL     1       3.593   1.011   0.446  1.00  0.00           C  
HETATM   11 CL2  UNL     1       5.096   1.778   0.968  1.00  0.00          CL  
HETATM   12  C10 UNL     1       3.132  -0.112   1.077  1.00  0.00           C  
HETATM   13  C11 UNL     1       1.941  -0.711   0.654  1.00  0.00           C  
HETATM   14  C12 UNL     1      -0.105  -2.293  -0.890  1.00  0.00           C  
HETATM   15 CL3  UNL     1       1.357  -2.893  -1.726  1.00  0.00          CL  
HETATM   16 CL4  UNL     1      -1.482  -2.755  -1.957  1.00  0.00          CL  
HETATM   17 CL5  UNL     1      -0.364  -3.092   0.644  1.00  0.00          CL  
HETATM   18  C13 UNL     1      -2.103   0.641  -0.915  1.00  0.00           C  
HETATM   19  C14 UNL     1      -3.181   1.237  -0.308  1.00  0.00           C  
HETATM   20  H1  UNL     1      -2.786   0.147   2.832  1.00  0.00           H  
HETATM   21  H2  UNL     1      -0.847  -0.922   1.772  1.00  0.00           H  
HETATM   22  H3  UNL     1      -0.137  -0.480  -1.957  1.00  0.00           H  
HETATM   23  H4  UNL     1       1.127   1.359  -1.844  1.00  0.00           H  
HETATM   24  H5  UNL     1       3.210   2.399  -1.099  1.00  0.00           H  
HETATM   25  H6  UNL     1       3.670  -0.558   1.906  1.00  0.00           H  
HETATM   26  H7  UNL     1       1.614  -1.582   1.168  1.00  0.00           H  
HETATM   27  H8  UNL     1      -1.930   0.791  -1.963  1.00  0.00           H  
HETATM   28  H9  UNL     1      -3.874   1.871  -0.883  1.00  0.00           H  
CONECT    1    2
CONECT    2    3    3   19
CONECT    3    4   20
CONECT    4    5    5   21
CONECT    5    6   18
CONECT    6    7   14   22
CONECT    7    8    8   13
CONECT    8    9   23
CONECT    9   10   10   24
CONECT   10   11   12
CONECT   12   13   13   25
CONECT   13   26
CONECT   14   15   16   17
CONECT   18   19   19   27
CONECT   19   28
END