COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.804  -1.906  -1.333  1.00  0.00           C  
HETATM    2  N   UNL     1       2.332  -0.474   0.932  1.00  0.00           N  
HETATM    3  O   UNL     1      -1.732   0.268  -1.119  1.00  0.00           O  
HETATM    4  C   UNL     1       0.209  -2.816  -1.060  1.00  0.00           C  
HETATM    5 CL   UNL     1      -2.174  -2.401  -2.278  1.00  0.00          Cl  
HETATM    6  C   UNL     1       1.302  -2.441  -0.312  1.00  0.00           C  
HETATM    7 CL   UNL     1      -3.868  -1.409   3.177  1.00  0.00          Cl  
HETATM    8  C   UNL     1       1.397  -1.142   0.177  1.00  0.00           C  
HETATM    9 CL   UNL     1      -3.793   2.246  -1.881  1.00  0.00          Cl  
HETATM   10  C   UNL     1       0.378  -0.213  -0.093  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.734  -0.614  -0.853  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.786  -0.468   0.882  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.769   0.342  -0.243  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.812   1.230  -0.474  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.865   1.303   0.419  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.880   0.495   1.540  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.842  -0.390   1.772  1.00  0.00           C  
HETATM   18  N   UNL     1       1.851   0.833   1.095  1.00  0.00           N  
HETATM   19  N   UNL     1       0.721   0.952   0.492  1.00  0.00           N  
HETATM   20  C   UNL     1       3.584  -1.020   1.462  1.00  0.00           C  
HETATM   21  C   UNL     1       4.713  -0.694   0.519  1.00  0.00           C  
HETATM   22  N   UNL     1       5.184  -1.487  -0.451  1.00  0.00           N  
HETATM   23  N   UNL     1       6.234  -0.850  -1.122  1.00  0.00           N  
HETATM   24  C   UNL     1       6.431   0.340  -0.584  1.00  0.00           C  
HETATM   25  C   UNL     1       5.443   0.480   0.498  1.00  0.00           C  
HETATM   26  N   UNL     1       7.283   1.349  -0.822  1.00  0.00           N  
HETATM   27  C   UNL     1       7.250   2.446  -0.109  1.00  0.00           C  
HETATM   28  C   UNL     1       6.343   2.639   0.932  1.00  0.00           C  
HETATM   29  C   UNL     1       5.428   1.678   1.244  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.997   2.266   0.169  1.00  0.00           C  
HETATM   31  N   UNL     1      -6.921   1.691  -0.817  1.00  0.00           N  
HETATM   32  H   UNL     1       0.139  -3.826  -1.438  1.00  0.00           H  
HETATM   33  H   UNL     1       2.085  -3.155  -0.104  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.978  -1.162   1.061  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.703   0.554   2.236  1.00  0.00           H  
HETATM   36  H   UNL     1       3.787  -0.581   2.439  1.00  0.00           H  
HETATM   37  H   UNL     1       3.495  -2.102   1.562  1.00  0.00           H  
HETATM   38  H   UNL     1       7.955   3.233  -0.335  1.00  0.00           H  
HETATM   39  H   UNL     1       6.358   3.563   1.490  1.00  0.00           H  
HETATM   40  H   UNL     1       4.722   1.823   2.048  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.529   2.450   1.102  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.597   3.206  -0.212  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.255   0.789  -0.516  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.689   2.319  -1.001  1.00  0.00           H  
HETATM   45  H   UNL     1       4.848  -2.373  -0.658  1.00  0.00           H  
CONECT    1    4    4    5   11                                       
CONECT    2   20    8   18                                            
CONECT    3   11   13                                                 
CONECT    4    1    1    6   32                                       
CONECT    5    1                                                      
CONECT    6    4    8    8   33                                       
CONECT    7   17                                                      
CONECT    8    2    6    6   10                                       
CONECT    9   14                                                      
CONECT   10    8   11   11   19                                       
CONECT   11    1    3   10   10                                       
CONECT   12   13   13   17   34                                       
CONECT   13    3   12   12   14                                       
CONECT   14    9   13   15   15                                       
CONECT   15   14   14   16   30                                       
CONECT   16   15   17   17   35                                       
CONECT   17    7   12   16   16                                       
CONECT   18    2   19   19                                            
CONECT   19   10   18   18                                            
CONECT   20    2   21   36   37                                       
CONECT   21   20   22   25   25                                       
CONECT   22   21   23   45                                            
CONECT   23   22   24   24                                            
CONECT   24   23   23   26   25                                       
CONECT   25   21   21   24   29                                       
CONECT   26   24   27   27                                            
CONECT   27   26   26   28   38                                       
CONECT   28   27   29   29   39                                       
CONECT   29   25   28   28   40                                       
CONECT   30   15   31   41   42                                       
CONECT   31   30   43   44                                            
CONECT   32    4                                                      
CONECT   33    6                                                      
CONECT   34   12                                                      
CONECT   35   16                                                      
CONECT   36   20                                                      
CONECT   37   20                                                      
CONECT   38   27                                                      
CONECT   39   28                                                      
CONECT   40   29                                                      
CONECT   41   30                                                      
CONECT   42   30                                                      
CONECT   43   31                                                      
CONECT   44   31                                                      
CONECT   45   22                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
