COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      38.489  38.067 -10.334  1.00  0.00           C  
HETATM    2 CL   UNL     1      38.793  38.451  -8.606  1.00  0.00          Cl  
HETATM    3 CL   UNL     1      38.727  36.343 -10.712  1.00  0.00          Cl  
HETATM    4  C   UNL     1      39.500  38.948 -11.144  1.00  0.00           C  
HETATM    5  O   UNL     1      40.632  39.158 -10.695  1.00  0.00           O  
HETATM    6  N   UNL     1      39.029  39.389 -12.224  1.00  0.00           N  
HETATM    7  C   UNL     1      39.564  40.260 -13.296  1.00  0.00           C  
HETATM    8  C   UNL     1      39.174  41.731 -13.062  1.00  0.00           C  
HETATM    9  C   UNL     1      39.740  39.576 -14.611  1.00  0.00           C  
HETATM   10  O   UNL     1      38.410  39.770 -15.130  1.00  0.00           O  
HETATM   11  C   UNL     1      40.324  38.290 -14.731  1.00  0.00           C  
HETATM   12  C   UNL     1      41.639  38.062 -14.377  1.00  0.00           C  
HETATM   13  C   UNL     1      42.157  36.742 -14.456  1.00  0.00           C  
HETATM   14  C   UNL     1      41.260  35.740 -14.856  1.00  0.00           C  
HETATM   15  N   UNL     1      41.784  34.338 -14.954  1.00  0.00           N1+
HETATM   16  O   UNL     1      40.969  33.494 -15.317  1.00  0.00           O1-
HETATM   17  O   UNL     1      42.934  34.126 -14.691  1.00  0.00           O  
HETATM   18  C   UNL     1      39.956  35.967 -15.155  1.00  0.00           C  
HETATM   19  C   UNL     1      39.464  37.256 -15.092  1.00  0.00           C  
HETATM   20  O   UNL     1      40.081  42.524 -12.263  1.00  0.00           O  
HETATM   21  O   UNL     1      43.400  40.237 -10.886  1.00  0.00           O  
HETATM   22  C   UNL     1      43.766  41.189 -10.237  1.00  0.00           C  
HETATM   23  O   UNL     1      45.065  41.335  -9.934  1.00  0.00           O  
HETATM   24  C   UNL     1      42.766  42.219  -9.778  1.00  0.00           C  
HETATM   25  C   UNL     1      41.358  41.810 -10.227  1.00  0.00           C  
HETATM   26  C   UNL     1      41.239  41.906 -11.724  1.00  0.00           C  
HETATM   27  O   UNL     1      42.100  41.444 -12.430  1.00  0.00           O  
HETATM   28  H   UNL     1      37.441  38.279 -10.591  1.00  0.00           H  
HETATM   29  H   UNL     1      38.091  39.086 -12.396  1.00  0.00           H  
HETATM   30  H   UNL     1      40.646  40.458 -13.285  1.00  0.00           H  
HETATM   31  H   UNL     1      39.109  42.210 -14.050  1.00  0.00           H  
HETATM   32  H   UNL     1      38.234  41.698 -12.493  1.00  0.00           H  
HETATM   33  H   UNL     1      40.576  39.994 -15.191  1.00  0.00           H  
HETATM   34  H   UNL     1      37.792  39.813 -14.410  1.00  0.00           H  
HETATM   35  H   UNL     1      42.265  38.877 -14.045  1.00  0.00           H  
HETATM   36  H   UNL     1      38.428  37.459 -15.319  1.00  0.00           H  
HETATM   37  H   UNL     1      43.188  36.521 -14.220  1.00  0.00           H  
HETATM   38  H   UNL     1      39.310  35.149 -15.439  1.00  0.00           H  
HETATM   39  H   UNL     1      45.559  40.611 -10.301  1.00  0.00           H  
HETATM   40  H   UNL     1      42.793  42.290  -8.681  1.00  0.00           H  
HETATM   41  H   UNL     1      43.020  43.194 -10.219  1.00  0.00           H  
HETATM   42  H   UNL     1      41.166  40.773  -9.915  1.00  0.00           H  
HETATM   43  H   UNL     1      40.624  42.486  -9.765  1.00  0.00           H  
CONECT    1    2    3    4   28                                       
CONECT    2    1                                                      
CONECT    3    1                                                      
CONECT    4    1    5    5    6                                       
CONECT    5    4    4                                                 
CONECT    6    4    7   29                                            
CONECT    7    6    8    9   30                                       
CONECT    8    7   20   31   32                                       
CONECT    9    7   10   11   33                                       
CONECT   10    9   34                                                 
CONECT   11    9   12   19   19                                       
CONECT   12   11   13   13   35                                       
CONECT   13   12   12   14   37                                       
CONECT   14   13   15   18   18                                       
CONECT   15   14   16   17   17                                       
CONECT   16   15                                                      
CONECT   17   15   15                                                 
CONECT   18   14   14   19   38                                       
CONECT   19   11   11   18   36                                       
CONECT   20    8   26                                                 
CONECT   21   22   22                                                 
CONECT   22   21   21   23   24                                       
CONECT   23   22   39                                                 
CONECT   24   22   25   40   41                                       
CONECT   25   24   26   42   43                                       
CONECT   26   20   25   27   27                                       
CONECT   27   26   26                                                 
CONECT   28    1                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   12                                                      
CONECT   36   19                                                      
CONECT   37   13                                                      
CONECT   38   18                                                      
CONECT   39   23                                                      
CONECT   40   24                                                      
CONECT   41   24                                                      
CONECT   42   25                                                      
CONECT   43   25                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
