COMPND    HMDB0245485
HETATM    1 CL1  UNL     1       5.237  -0.283   0.164  1.00  0.00          CL  
HETATM    2  C1  UNL     1       3.489  -0.184   0.108  1.00  0.00           C  
HETATM    3  C2  UNL     1       2.742  -0.774   1.106  1.00  0.00           C  
HETATM    4  C3  UNL     1       1.350  -0.724   1.107  1.00  0.00           C  
HETATM    5  C4  UNL     1       0.666  -0.075   0.101  1.00  0.00           C  
HETATM    6  C5  UNL     1      -0.794   0.005   0.058  1.00  0.00           C  
HETATM    7  C6  UNL     1      -1.379   1.240  -0.233  1.00  0.00           C  
HETATM    8  C7  UNL     1      -2.724   1.413  -0.294  1.00  0.00           C  
HETATM    9  C8  UNL     1      -3.548   0.336  -0.061  1.00  0.00           C  
HETATM   10  C9  UNL     1      -2.982  -0.879   0.225  1.00  0.00           C  
HETATM   11  C10 UNL     1      -1.609  -1.084   0.293  1.00  0.00           C  
HETATM   12 CL2  UNL     1      -0.912  -2.634   0.657  1.00  0.00          CL  
HETATM   13  C11 UNL     1       1.428   0.515  -0.896  1.00  0.00           C  
HETATM   14  C12 UNL     1       2.807   0.462  -0.894  1.00  0.00           C  
HETATM   15  H1  UNL     1       3.257  -1.291   1.909  1.00  0.00           H  
HETATM   16  H2  UNL     1       0.778  -1.193   1.900  1.00  0.00           H  
HETATM   17  H3  UNL     1      -0.716   2.075  -0.412  1.00  0.00           H  
HETATM   18  H4  UNL     1      -3.107   2.396  -0.524  1.00  0.00           H  
HETATM   19  H5  UNL     1      -4.623   0.450  -0.105  1.00  0.00           H  
HETATM   20  H6  UNL     1      -3.607  -1.729   0.408  1.00  0.00           H  
HETATM   21  H7  UNL     1       0.875   1.028  -1.690  1.00  0.00           H  
HETATM   22  H8  UNL     1       3.372   0.932  -1.686  1.00  0.00           H  
CONECT    1    2
CONECT    2    3    3   14
CONECT    3    4   15
CONECT    4    5    5   16
CONECT    5    6   13
CONECT    6    7    7   11
CONECT    7    8   17
CONECT    8    9    9   18
CONECT    9   10   19
CONECT   10   11   11   20
CONECT   11   12
CONECT   13   14   14   21
CONECT   14   22
END