COMPND    HMDB0245368
HETATM    1 CL1  UNL     1       4.000  -1.083   2.042  1.00  0.00          CL  
HETATM    2  C1  UNL     1       2.919  -0.449   0.794  1.00  0.00           C  
HETATM    3  C2  UNL     1       3.441   0.132  -0.338  1.00  0.00           C  
HETATM    4  C3  UNL     1       2.612   0.632  -1.320  1.00  0.00           C  
HETATM    5  C4  UNL     1       1.239   0.569  -1.205  1.00  0.00           C  
HETATM    6 CL2  UNL     1       0.164   1.203  -2.452  1.00  0.00          CL  
HETATM    7  C5  UNL     1       0.732  -0.022  -0.053  1.00  0.00           C  
HETATM    8  C6  UNL     1      -0.725  -0.077   0.047  1.00  0.00           C  
HETATM    9  C7  UNL     1      -1.428  -1.156  -0.443  1.00  0.00           C  
HETATM   10 CL3  UNL     1      -0.493  -2.448  -1.185  1.00  0.00          CL  
HETATM   11  C8  UNL     1      -2.804  -1.202  -0.346  1.00  0.00           C  
HETATM   12  C9  UNL     1      -3.505  -0.165   0.245  1.00  0.00           C  
HETATM   13  C10 UNL     1      -2.798   0.918   0.737  1.00  0.00           C  
HETATM   14 CL4  UNL     1      -3.651   2.269   1.502  1.00  0.00          CL  
HETATM   15  C11 UNL     1      -1.421   0.957   0.636  1.00  0.00           C  
HETATM   16 CL5  UNL     1      -0.589   2.372   1.286  1.00  0.00          CL  
HETATM   17  C12 UNL     1       1.548  -0.516   0.918  1.00  0.00           C  
HETATM   18  H1  UNL     1       4.520   0.196  -0.458  1.00  0.00           H  
HETATM   19  H2  UNL     1       3.038   1.091  -2.217  1.00  0.00           H  
HETATM   20  H3  UNL     1      -3.314  -2.069  -0.744  1.00  0.00           H  
HETATM   21  H4  UNL     1      -4.595  -0.189   0.329  1.00  0.00           H  
HETATM   22  H5  UNL     1       1.109  -0.963   1.790  1.00  0.00           H  
CONECT    1    2
CONECT    2    3    3   17
CONECT    3    4   18
CONECT    4    5    5   19
CONECT    5    6    7
CONECT    7    8   17   17
CONECT    8    9    9   15
CONECT    9   10   11
CONECT   11   12   12   20
CONECT   12   13   21
CONECT   13   14   15   15
CONECT   15   16
CONECT   17   22
END