COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.789  -1.606  -2.111  1.00  0.00           C  
HETATM    2  C   UNL     1       2.967  -1.070  -0.967  1.00  0.00           C  
HETATM    3  C   UNL     1       1.957  -0.158  -1.210  1.00  0.00           C  
HETATM    4  C   UNL     1       1.458  -0.087   1.131  1.00  0.00           C  
HETATM    5  C   UNL     1       2.463  -1.003   1.374  1.00  0.00           C  
HETATM    6  C   UNL     1       3.219  -1.495   0.325  1.00  0.00           C  
HETATM    7  C   UNL     1       0.282   2.542   0.487  1.00  0.00           C  
HETATM    8  C   UNL     1       1.559   3.256   0.129  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.233   0.686  -0.152  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.582   0.358   1.152  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.330  -0.160  -0.938  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.087   0.437  -1.186  1.00  0.00           C  
HETATM   13  C   UNL     1       1.203   0.333  -0.161  1.00  0.00           C  
HETATM   14 CL   UNL     1       4.483  -2.646   0.629  1.00  0.00          Cl  
HETATM   15  C   UNL     1       0.102   1.328  -0.426  1.00  0.00           C  
HETATM   16  O   UNL     1       2.255   2.837  -0.765  1.00  0.00           O  
HETATM   17  O   UNL     1       1.924   4.358   0.803  1.00  0.00           O  
HETATM   18  C   UNL     1      -2.800  -0.224   1.423  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.685  -0.486   0.383  1.00  0.00           C  
HETATM   20  N   UNL     1      -4.940  -1.041   0.315  1.00  0.00           N  
HETATM   21  C   UNL     1      -5.738  -1.545   1.435  1.00  0.00           C  
HETATM   22  N   UNL     1      -5.308  -1.029  -1.039  1.00  0.00           N  
HETATM   23  N   UNL     1      -4.358  -0.511  -1.736  1.00  0.00           N  
HETATM   24  H   UNL     1       3.317  -2.504  -2.509  1.00  0.00           H  
HETATM   25  H   UNL     1       3.855  -0.852  -2.895  1.00  0.00           H  
HETATM   26  H   UNL     1       4.791  -1.849  -1.756  1.00  0.00           H  
HETATM   27  H   UNL     1       1.758   0.170  -2.219  1.00  0.00           H  
HETATM   28  H   UNL     1       0.867   0.296   1.950  1.00  0.00           H  
HETATM   29  H   UNL     1       2.659  -1.335   2.383  1.00  0.00           H  
HETATM   30  H   UNL     1       0.329   2.212   1.525  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.562   3.221   0.360  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.893   0.562   1.959  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.806   0.701  -2.194  1.00  0.00           H  
HETATM   34  H   UNL     1       0.144   1.648  -1.467  1.00  0.00           H  
HETATM   35  H   UNL     1       2.752   4.781   0.538  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.068  -0.473   2.439  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.354  -0.739   1.834  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.380  -2.355   1.089  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.075  -1.916   2.216  1.00  0.00           H  
CONECT    1    2   24   25   26                                       
CONECT    2    3    1    6    6                                       
CONECT    3   13   13    2   27                                       
CONECT    4   13    5    5   28                                       
CONECT    5    4    4    6   29                                       
CONECT    6    2    2    5   14                                       
CONECT    7    8   15   30   31                                       
CONECT    8   16   16   17    7                                       
CONECT    9   10   10   12   15                                       
CONECT   10   18    9    9   32                                       
CONECT   11   19   23   12   12                                       
CONECT   12   11   11    9   33                                       
CONECT   13   15    3    3    4                                       
CONECT   14    6                                                      
CONECT   15    7    9   13   34                                       
CONECT   16    8    8                                                 
CONECT   17    8   35                                                 
CONECT   18   19   19   10   36                                       
CONECT   19   18   18   20   11                                       
CONECT   20   21   19   22                                            
CONECT   21   20   37   38   39                                       
CONECT   22   20   23   23                                            
CONECT   23   22   22   11                                            
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    7                                                      
CONECT   31    7                                                      
CONECT   32   10                                                      
CONECT   33   12                                                      
CONECT   34   15                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   21                                                      
CONECT   38   21                                                      
CONECT   39   21                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
