COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.262  -0.205  -0.521  1.00  0.00           C  
HETATM    2  C   UNL     1       0.393  -1.421  -1.174  1.00  0.00           C  
HETATM    3  C   UNL     1       1.613  -2.071  -1.185  1.00  0.00           C  
HETATM    4  C   UNL     1       5.089  -1.722  -2.050  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.129  -0.141  -1.181  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.047   0.952  -1.665  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.542   2.633  -1.167  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.714   2.930  -2.506  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.020   2.196  -3.456  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.172   1.188  -3.021  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.870  -1.028  -0.214  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.385  -2.238  -0.641  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.064  -3.052   0.245  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.230  -2.657   1.560  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.715  -1.446   1.988  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.030  -0.634   1.101  1.00  0.00           C  
HETATM   17  C   UNL     1       2.353   2.396   0.958  1.00  0.00           C  
HETATM   18  C   UNL     1       4.582   2.794   0.548  1.00  0.00           C  
HETATM   19  C   UNL     1       4.503   3.954   1.302  1.00  0.00           C  
HETATM   20  C   UNL     1       2.705  -1.512  -0.547  1.00  0.00           C  
HETATM   21  C   UNL     1       2.583  -0.300   0.107  1.00  0.00           C  
HETATM   22  C   UNL     1       1.364   0.362   0.119  1.00  0.00           C  
HETATM   23  N   UNL     1      -0.972   0.456  -0.508  1.00  0.00           N  
HETATM   24  S   UNL     1       4.256  -2.348  -0.565  1.00  0.00           S  
HETATM   25  O   UNL     1       3.914  -3.718  -0.726  1.00  0.00           O  
HETATM   26  O   UNL     1       4.915  -1.890   0.607  1.00  0.00           O  
HETATM   27  N   UNL     1      -3.727   1.667  -0.790  1.00  0.00           N  
HETATM   28 CL   UNL     1      -3.923  -0.949   3.638  1.00  0.00          Cl  
HETATM   29  N   UNL     1       1.240   1.593   0.776  1.00  0.00           N  
HETATM   30  N   UNL     1       3.502   2.046   0.398  1.00  0.00           N  
HETATM   31  C   UNL     1       3.286   4.290   1.875  1.00  0.00           C  
HETATM   32  N   UNL     1       2.243   3.499   1.685  1.00  0.00           N  
HETATM   33  H   UNL     1      -0.458  -1.860  -1.673  1.00  0.00           H  
HETATM   34  H   UNL     1       1.714  -3.018  -1.694  1.00  0.00           H  
HETATM   35  H   UNL     1       5.210  -0.641  -1.970  1.00  0.00           H  
HETATM   36  H   UNL     1       6.069  -2.191  -2.142  1.00  0.00           H  
HETATM   37  H   UNL     1       4.490  -1.956  -2.929  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.790  -0.733  -2.030  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.082   3.198  -0.422  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.383   3.722  -2.809  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.134   2.405  -4.509  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.616   0.596  -3.732  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.256  -2.547  -1.668  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.466  -3.997  -0.089  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.761  -3.293   2.252  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.628   0.311   1.435  1.00  0.00           H  
HETATM   47  H   UNL     1       5.516   2.503   0.089  1.00  0.00           H  
HETATM   48  H   UNL     1       5.370   4.582   1.441  1.00  0.00           H  
HETATM   49  H   UNL     1       3.438   0.133   0.605  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.062   1.308  -0.054  1.00  0.00           H  
HETATM   51  H   UNL     1       0.374   1.883   1.102  1.00  0.00           H  
HETATM   52  H   UNL     1       3.190   5.187   2.468  1.00  0.00           H  
CONECT    1    2   23   22   22                                       
CONECT    2    3    3    1   33                                       
CONECT    3    2    2   20   34                                       
CONECT    4   24   35   36   37                                       
CONECT    5   11    6   23   38                                       
CONECT    6    5   10   10   27                                       
CONECT    7   27   27    8   39                                       
CONECT    8    9    9    7   40                                       
CONECT    9   10    8    8   41                                       
CONECT   10    6    6    9   42                                       
CONECT   11   16   16   12    5                                       
CONECT   12   13   13   11   43                                       
CONECT   13   14   12   12   44                                       
CONECT   14   15   15   13   45                                       
CONECT   15   28   14   14   16                                       
CONECT   16   15   11   11   46                                       
CONECT   17   29   32   32   30                                       
CONECT   18   30   30   19   47                                       
CONECT   19   31   31   18   48                                       
CONECT   20    3   24   21   21                                       
CONECT   21   20   20   22   49                                       
CONECT   22    1    1   21   29                                       
CONECT   23    5    1   50                                            
CONECT   24   26   26    4   20                                       
CONECT   24   25   25                                                 
CONECT   25   24   24                                                 
CONECT   26   24   24                                                 
CONECT   27    6    7    7                                            
CONECT   28   15                                                      
CONECT   29   22   17   51                                            
CONECT   30   17   18   18                                            
CONECT   31   32   19   19   52                                       
CONECT   32   17   17   31                                            
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   16                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   21                                                      
CONECT   50   23                                                      
CONECT   51   29                                                      
CONECT   52   31                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
