COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.519   2.645   0.410  1.00  0.00           C  
HETATM    2  N   UNL     1      -1.093  -1.099   0.134  1.00  0.00           N  
HETATM    3  C   UNL     1      -0.426  -2.400   0.040  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.784  -3.247   1.263  1.00  0.00           C  
HETATM    5  C   UNL     1       1.920  -3.222  -0.098  1.00  0.00           C  
HETATM    6  C   UNL     1       3.711   0.302   0.007  1.00  0.00           C  
HETATM    7  C   UNL     1       5.103   0.238  -0.060  1.00  0.00           C  
HETATM    8  C   UNL     1       3.077   1.542   0.095  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.438  -1.035   0.192  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.502   0.155   0.338  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.074   0.226  -1.081  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.038   1.401  -0.290  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.523   1.363   1.151  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.989   1.375   1.130  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.090   2.648  -1.011  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.886  -3.119  -1.230  1.00  0.00           C  
HETATM   17  C   UNL     1       1.066  -2.197  -0.011  1.00  0.00           C  
HETATM   18  C   UNL     1       2.909  -0.940  -0.023  1.00  0.00           C  
HETATM   19  C   UNL     1       5.848   1.404  -0.033  1.00  0.00           C  
HETATM   20  C   UNL     1       5.209   2.635   0.061  1.00  0.00           C  
HETATM   21  C   UNL     1       3.828   2.700   0.122  1.00  0.00           C  
HETATM   22  F   UNL     1       5.938   3.772   0.088  1.00  0.00           F  
HETATM   23  N   UNL     1      -5.896   1.437  -1.214  1.00  0.00           N  
HETATM   24  N   UNL     1       1.609  -1.002   0.028  1.00  0.00           N  
HETATM   25  O   UNL     1      -3.097  -2.055   0.167  1.00  0.00           O  
HETATM   26  O   UNL     1      -3.051   0.161   0.279  1.00  0.00           O  
HETATM   27  O   UNL     1       7.205   1.345  -0.097  1.00  0.00           O  
HETATM   28  S   UNL     1       3.559  -2.574  -0.133  1.00  0.00           S  
HETATM   29  H   UNL     1      -4.876   3.523   0.949  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.430   2.661   0.367  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.567  -0.285   0.154  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.863  -3.394   1.300  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.288  -4.214   1.194  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.456  -2.734   2.168  1.00  0.00           H  
HETATM   35  H   UNL     1       1.652  -4.268  -0.136  1.00  0.00           H  
HETATM   36  H   UNL     1       5.598  -0.719  -0.133  1.00  0.00           H  
HETATM   37  H   UNL     1       1.999   1.596   0.143  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.846  -0.758   0.824  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.256   0.261  -1.801  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.688  -0.654  -1.270  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.636   0.511  -0.486  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.651   2.291  -0.434  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.887   2.237   1.692  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.877   0.457   1.642  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.588   1.348   2.143  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.716   3.529  -1.149  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.272   2.666  -1.731  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.631  -2.516  -2.101  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.390  -4.087  -1.299  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.966  -3.266  -1.193  1.00  0.00           H  
HETATM   51  H   UNL     1       3.336   3.659   0.195  1.00  0.00           H  
HETATM   52  H   UNL     1       7.557   1.374  -0.997  1.00  0.00           H  
CONECT    1   14   15   29   30                                       
CONECT    2    9    3   31                                            
CONECT    3   16    2    4   17                                       
CONECT    4    3   32   33   34                                       
CONECT    5   17   17   28   35                                       
CONECT    6    7   18    8    8                                       
CONECT    7   19   19    6   36                                       
CONECT    8    6    6   21   37                                       
CONECT    9   25   25    2   26                                       
CONECT   10   26   11   14   38                                       
CONECT   11   10   23   39   40                                       
CONECT   12   23   13   41   42                                       
CONECT   13   14   12   43   44                                       
CONECT   14   10    1   13   45                                       
CONECT   15    1   23   46   47                                       
CONECT   16    3   48   49   50                                       
CONECT   17    3   24    5    5                                       
CONECT   18   24   24    6   28                                       
CONECT   19   27    7    7   20                                       
CONECT   20   19   22   21   21                                       
CONECT   21   20   20    8   51                                       
CONECT   22   20                                                      
CONECT   23   11   15   12                                            
CONECT   24   17   18   18                                            
CONECT   25    9    9                                                 
CONECT   26    9   10                                                 
CONECT   27   19   52                                                 
CONECT   28   18    5                                                 
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   16                                                      
CONECT   51   21                                                      
CONECT   52   27                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
