COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.342   0.191   0.516  1.00  0.00           C  
HETATM    2  C   UNL     1       0.924  -0.236   0.166  1.00  0.00           C  
HETATM    3  C   UNL     1       1.089  -1.436  -0.510  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.020  -2.205  -0.833  1.00  0.00           C  
HETATM    5  C   UNL     1       4.036  -0.267  -1.336  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.826  -0.111   0.581  1.00  0.00           C  
HETATM    7  C   UNL     1       4.920  -0.450   1.282  1.00  0.00           C  
HETATM    8  C   UNL     1       5.551   0.403   0.394  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.446  -0.576   0.193  1.00  0.00           C  
HETATM   10  C   UNL     1       5.112   0.490  -0.916  1.00  0.00           C  
HETATM   11  C   UNL     1       3.395  -1.115  -0.445  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.285  -1.774  -0.481  1.00  0.00           C  
HETATM   13  O   UNL     1       2.333  -1.858  -0.855  1.00  0.00           O  
HETATM   14  O   UNL     1      -3.504  -1.159   1.293  1.00  0.00           O  
HETATM   15  O   UNL     1      -2.725   1.037   1.433  1.00  0.00           O  
HETATM   16  C   UNL     1       3.840  -1.205   0.867  1.00  0.00           C  
HETATM   17 CL   UNL     1       6.903   1.356   0.920  1.00  0.00          Cl  
HETATM   18 CL   UNL     1      -2.673  -2.735  -0.885  1.00  0.00          Cl  
HETATM   19  C   UNL     1      -4.294  -0.474   2.295  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.361   0.701   2.682  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.618   0.251  -0.677  1.00  0.00           C  
HETATM   22  N   UNL     1      -2.936   1.334  -1.390  1.00  0.00           N  
HETATM   23  N   UNL     1      -2.553   2.579  -0.863  1.00  0.00           N  
HETATM   24  C   UNL     1      -1.976   3.238  -1.834  1.00  0.00           C  
HETATM   25  N   UNL     1      -1.975   2.481  -2.930  1.00  0.00           N  
HETATM   26  C   UNL     1      -2.545   1.331  -2.676  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.174   1.884   3.212  1.00  0.00           C  
HETATM   28  H   UNL     1      -0.470   1.123   1.046  1.00  0.00           H  
HETATM   29  H   UNL     1       1.785   0.365   0.419  1.00  0.00           H  
HETATM   30  H   UNL     1       0.106  -3.140  -1.360  1.00  0.00           H  
HETATM   31  H   UNL     1       3.691  -0.196  -2.357  1.00  0.00           H  
HETATM   32  H   UNL     1       5.266  -0.520   2.302  1.00  0.00           H  
HETATM   33  H   UNL     1       5.611   1.151  -1.609  1.00  0.00           H  
HETATM   34  H   UNL     1       3.348  -1.871   1.560  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.228  -0.108   1.871  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.483  -1.121   3.152  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.622   0.380   3.417  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.690  -0.622  -1.325  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.619   0.577  -0.394  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.567   4.234  -1.758  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.680   0.521  -3.378  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.735   1.574   4.093  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.500   2.698   3.478  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.866   2.223   2.441  1.00  0.00           H  
CONECT    1    2    2    9   28                                       
CONECT    2    3    1    1   29                                       
CONECT    3   13    4    4    2                                       
CONECT    4    3    3   12   30                                       
CONECT    5   10   11   11   31                                       
CONECT    6    9   14   15   21                                       
CONECT    7    8   16   16   32                                       
CONECT    8   17   10   10    7                                       
CONECT    9   12   12    1    6                                       
CONECT   10    8    8    5   33                                       
CONECT   11    5    5   16   13                                       
CONECT   12    4   18    9    9                                       
CONECT   13   11    3                                                 
CONECT   14    6   19                                                 
CONECT   15    6   20                                                 
CONECT   16    7    7   11   34                                       
CONECT   17    8                                                      
CONECT   18   12                                                      
CONECT   19   14   20   35   36                                       
CONECT   20   19   15   27   37                                       
CONECT   21    6   22   38   39                                       
CONECT   22   23   21   26                                            
CONECT   23   22   24   24                                            
CONECT   24   23   23   25   40                                       
CONECT   25   24   26   26                                            
CONECT   26   22   25   25   41                                       
CONECT   27   20   42   43   44                                       
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    7                                                      
CONECT   33   10                                                      
CONECT   34   16                                                      
CONECT   35   19                                                      
CONECT   36   19                                                      
CONECT   37   20                                                      
CONECT   38   21                                                      
CONECT   39   21                                                      
CONECT   40   24                                                      
CONECT   41   26                                                      
CONECT   42   27                                                      
CONECT   43   27                                                      
CONECT   44   27                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
