COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       5.039  -2.228   1.689  1.00  0.00           N  
HETATM    2  N   UNL     1      -1.576  -0.034  -0.493  1.00  0.00           N  
HETATM    3  C   UNL     1       3.034  -1.021  -1.033  1.00  0.00           C  
HETATM    4  C   UNL     1       1.614   0.461  -2.387  1.00  0.00           C  
HETATM    5  C   UNL     1       0.301   0.943  -1.774  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.391  -0.218  -1.107  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.264  -1.128   0.038  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.526  -3.335   1.113  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.440  -1.346   0.043  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.448  -0.132  -0.515  1.00  0.00           C  
HETATM   11  C   UNL     1       0.549   2.023  -0.754  1.00  0.00           C  
HETATM   12  C   UNL     1       0.869   4.039   1.125  1.00  0.00           C  
HETATM   13  C   UNL     1       1.928   3.219   0.794  1.00  0.00           C  
HETATM   14  C   UNL     1       1.772   2.213  -0.150  1.00  0.00           C  
HETATM   15 CL   UNL     1      -1.696   4.886   0.917  1.00  0.00          Cl  
HETATM   16  C   UNL     1      -0.358   3.856   0.513  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.515   2.852  -0.422  1.00  0.00           C  
HETATM   18  C   UNL     1       2.977   1.370  -0.484  1.00  0.00           C  
HETATM   19  N   UNL     1       2.563   0.215  -1.289  1.00  0.00           N  
HETATM   20  O   UNL     1       2.699  -1.957  -1.734  1.00  0.00           O  
HETATM   21  C   UNL     1       3.953  -1.240   0.095  1.00  0.00           C  
HETATM   22  C   UNL     1       4.773  -0.299   0.694  1.00  0.00           C  
HETATM   23  C   UNL     1       5.445  -0.985   1.707  1.00  0.00           C  
HETATM   24  N   UNL     1       4.169  -2.413   0.762  1.00  0.00           N  
HETATM   25  C   UNL     1       3.509  -3.687   0.464  1.00  0.00           C  
HETATM   26  O   UNL     1       0.120  -1.318  -1.123  1.00  0.00           O  
HETATM   27  C   UNL     1      -3.676  -1.169   0.024  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.807  -0.230  -0.501  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.721  -2.372   0.575  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.318  -2.307   0.578  1.00  0.00           C  
HETATM   31  N   UNL     1      -2.218  -3.240   1.091  1.00  0.00           N  
HETATM   32  C   UNL     1      -1.581  -2.194   0.584  1.00  0.00           C  
HETATM   33  H   UNL     1      -1.951   0.857  -0.419  1.00  0.00           H  
HETATM   34  H   UNL     1       1.446  -0.461  -2.942  1.00  0.00           H  
HETATM   35  H   UNL     1       2.012   1.226  -3.054  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.341   1.336  -2.563  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.995  -4.209   1.539  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.519  -1.398   0.041  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.969   0.738  -0.939  1.00  0.00           H  
HETATM   40  H   UNL     1       0.997   4.820   1.860  1.00  0.00           H  
HETATM   41  H   UNL     1       2.885   3.361   1.272  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.474   2.710  -0.899  1.00  0.00           H  
HETATM   43  H   UNL     1       3.692   1.968  -1.049  1.00  0.00           H  
HETATM   44  H   UNL     1       3.443   1.022   0.437  1.00  0.00           H  
HETATM   45  H   UNL     1       4.871   0.744   0.432  1.00  0.00           H  
HETATM   46  H   UNL     1       6.172  -0.563   2.386  1.00  0.00           H  
HETATM   47  H   UNL     1       4.138  -4.274  -0.205  1.00  0.00           H  
HETATM   48  H   UNL     1       3.349  -4.238   1.391  1.00  0.00           H  
HETATM   49  H   UNL     1       2.549  -3.495  -0.014  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.402   0.569  -0.916  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.226  -3.231   0.993  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.501  -2.178   0.597  1.00  0.00           H  
CONECT    1   24   23   23                                            
CONECT    2    7    6   33                                            
CONECT    3   20   20   19   21                                       
CONECT    4    5   19   34   35                                       
CONECT    5    6    4   11   36                                       
CONECT    6    2    5   26   26                                       
CONECT    7   27   27   32    2                                       
CONECT    8   30   30   31   37                                       
CONECT    9   29   29   28   38                                       
CONECT   10   28   28   27   39                                       
CONECT   11    5   17   17   14                                       
CONECT   12   16   16   13   40                                       
CONECT   13   14   14   12   41                                       
CONECT   14   11   18   13   13                                       
CONECT   15   16                                                      
CONECT   16   17   15   12   12                                       
CONECT   17   11   11   16   42                                       
CONECT   18   19   14   43   44                                       
CONECT   19    4    3   18                                            
CONECT   20    3    3                                                 
CONECT   21    3   24   22   22                                       
CONECT   22   21   21   23   45                                       
CONECT   23   22    1    1   46                                       
CONECT   24   25   21    1                                            
CONECT   25   24   47   48   49                                       
CONECT   26    6    6                                                 
CONECT   27   30   10    7    7                                       
CONECT   28    9   10   10   50                                       
CONECT   29    9    9   30   51                                       
CONECT   30   29    8    8   27                                       
CONECT   31    8   32   32                                            
CONECT   32   31   31    7   52                                       
CONECT   33    2                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   32                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
