COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.743   1.877   0.616  1.00  0.00           C  
HETATM    2  C   UNL     1       2.810  -1.636  -0.328  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.593  -0.419   0.967  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.916  -0.922   0.853  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.801  -1.939   0.519  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.449  -0.416  -0.016  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.624   0.654   0.311  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.334   0.403   0.747  1.00  0.00           C  
HETATM    9  C   UNL     1      -8.501   0.862  -1.047  1.00  0.00           C  
HETATM   10  C   UNL     1      -8.720  -0.514  -1.157  1.00  0.00           C  
HETATM   11  C   UNL     1       1.920  -1.420  -2.543  1.00  0.00           C  
HETATM   12  C   UNL     1       3.906  -2.461   0.350  1.00  0.00           C  
HETATM   13  N   UNL     1       3.792   0.625   0.059  1.00  0.00           N  
HETATM   14  N   UNL     1       4.982   0.531  -0.672  1.00  0.00           N  
HETATM   15  C   UNL     1       5.634   1.669  -0.570  1.00  0.00           C  
HETATM   16  C   UNL     1       4.900   2.539   0.224  1.00  0.00           C  
HETATM   17 CL   UNL     1       7.164   2.025  -1.308  1.00  0.00          Cl  
HETATM   18  N   UNL     1       2.706   2.244   1.380  1.00  0.00           N  
HETATM   19  C   UNL     1       1.714   1.418   1.613  1.00  0.00           C  
HETATM   20  C   UNL     1       1.725   0.124   1.060  1.00  0.00           C  
HETATM   21  C   UNL     1       2.771  -0.257   0.278  1.00  0.00           C  
HETATM   22  N   UNL     1       0.665  -0.762   1.307  1.00  0.00           N  
HETATM   23  O   UNL     1       3.087  -1.535  -1.726  1.00  0.00           O  
HETATM   24  N   UNL     1      -1.623  -1.225   1.295  1.00  0.00           N  
HETATM   25  O   UNL     1      -0.799   0.616   0.364  1.00  0.00           O  
HETATM   26  N   UNL     1      -5.020  -1.662   0.102  1.00  0.00           N  
HETATM   27 CL   UNL     1      -5.196   2.285   0.152  1.00  0.00          Cl  
HETATM   28  N   UNL     1      -6.753  -0.172  -0.463  1.00  0.00           N  
HETATM   29  N   UNL     1      -7.267   0.997  -0.614  1.00  0.00           N  
HETATM   30  N   UNL     1      -7.599  -1.087  -0.781  1.00  0.00           N  
HETATM   31  C   UNL     1       4.030  -3.817  -0.348  1.00  0.00           C  
HETATM   32  O   UNL     1       5.151  -1.764   0.261  1.00  0.00           O  
HETATM   33  C   UNL     1       6.042  -2.023   1.347  1.00  0.00           C  
HETATM   34  H   UNL     1       1.846  -2.124  -0.183  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.487  -2.969   0.603  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.668   1.214   0.999  1.00  0.00           H  
HETATM   37  H   UNL     1      -9.200   1.653  -1.275  1.00  0.00           H  
HETATM   38  H   UNL     1      -9.625  -1.005  -1.485  1.00  0.00           H  
HETATM   39  H   UNL     1       1.291  -2.299  -2.402  1.00  0.00           H  
HETATM   40  H   UNL     1       1.364  -0.527  -2.259  1.00  0.00           H  
HETATM   41  H   UNL     1       2.214  -1.348  -3.590  1.00  0.00           H  
HETATM   42  H   UNL     1       3.650  -2.614   1.398  1.00  0.00           H  
HETATM   43  H   UNL     1       5.178   3.548   0.489  1.00  0.00           H  
HETATM   44  H   UNL     1       0.888   1.730   2.235  1.00  0.00           H  
HETATM   45  H   UNL     1       0.838  -1.621   1.723  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.468  -2.014   1.837  1.00  0.00           H  
HETATM   47  H   UNL     1       4.286  -3.664  -1.396  1.00  0.00           H  
HETATM   48  H   UNL     1       4.811  -4.404   0.135  1.00  0.00           H  
HETATM   49  H   UNL     1       3.081  -4.348  -0.279  1.00  0.00           H  
HETATM   50  H   UNL     1       5.571  -1.722   2.283  1.00  0.00           H  
HETATM   51  H   UNL     1       6.271  -3.088   1.383  1.00  0.00           H  
HETATM   52  H   UNL     1       6.962  -1.458   1.205  1.00  0.00           H  
CONECT    1   18   13   16   16                                       
CONECT    2   12   21   23   34                                       
CONECT    3   25   25   24   22                                       
CONECT    4    8    8    5   24                                       
CONECT    5   26   26    4   35                                       
CONECT    6   28    7    7   26                                       
CONECT    7   27    6    6    8                                       
CONECT    8    7    4    4   36                                       
CONECT    9   29   29   10   37                                       
CONECT   10    9   30   30   38                                       
CONECT   11   23   39   40   41                                       
CONECT   12   32   31    2   42                                       
CONECT   13   21    1   14                                            
CONECT   14   13   15   15                                            
CONECT   15   16   14   14   17                                       
CONECT   16    1    1   15   43                                       
CONECT   17   15                                                      
CONECT   18   19   19    1                                            
CONECT   19   20   18   18   44                                       
CONECT   20   22   19   21   21                                       
CONECT   21   20   20    2   13                                       
CONECT   22    3   20   45                                            
CONECT   23    2   11                                                 
CONECT   24    4    3   46                                            
CONECT   25    3    3                                                 
CONECT   26    6    5    5                                            
CONECT   27    7                                                      
CONECT   28   29   30    6                                            
CONECT   29    9    9   28                                            
CONECT   30   10   10   28                                            
CONECT   31   12   47   48   49                                       
CONECT   32   33   12                                                 
CONECT   33   32   50   51   52                                       
CONECT   34    2                                                      
CONECT   35    5                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   16                                                      
CONECT   44   19                                                      
CONECT   45   22                                                      
CONECT   46   24                                                      
CONECT   47   31                                                      
CONECT   48   31                                                      
CONECT   49   31                                                      
CONECT   50   33                                                      
CONECT   51   33                                                      
CONECT   52   33                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
