COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.744   0.923  -1.860  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.277   3.025   0.428  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.506   3.896   1.150  1.00  0.00           C  
HETATM    4  C   UNL     1       3.412  -1.463  -1.118  1.00  0.00           C  
HETATM    5  C   UNL     1       5.720  -2.046   0.143  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.006  -0.003  -1.870  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.157  -1.277  -1.810  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.404  -0.289  -1.389  1.00  0.00           C  
HETATM    9  C   UNL     1       1.104  -0.915  -1.010  1.00  0.00           C  
HETATM   10  C   UNL     1       0.988   0.585  -0.699  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.000   2.092  -0.506  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.795  -0.258  -1.641  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.849  -0.965  -0.315  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.993  -0.403  -2.580  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.115   4.287   0.645  1.00  0.00           C  
HETATM   16  C   UNL     1       2.047   3.726   0.649  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.547   4.860   0.577  1.00  0.00           C  
HETATM   18  C   UNL     1       4.596  -1.715  -1.829  1.00  0.00           C  
HETATM   19  C   UNL     1       4.526  -1.792   0.864  1.00  0.00           C  
HETATM   20  C   UNL     1       4.543  -1.846   2.268  1.00  0.00           C  
HETATM   21  C   UNL     1       6.898  -2.347   0.845  1.00  0.00           C  
HETATM   22  C   UNL     1       4.588  -1.661  -3.335  1.00  0.00           C  
HETATM   23  C   UNL     1       5.700  -2.140   2.920  1.00  0.00           C  
HETATM   24  C   UNL     1       6.879  -2.391   2.211  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.212  -3.069   1.728  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.558  -3.726   3.066  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.895  -4.438   1.755  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.054  -1.868   1.292  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.651   1.298  -0.717  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.377   2.365  -0.003  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.164   3.193  -0.344  1.00  0.00           C  
HETATM   32  C   UNL     1      -4.944   4.255   0.734  1.00  0.00           C  
HETATM   33  C   UNL     1       4.307   4.388   1.031  1.00  0.00           C  
HETATM   34  C   UNL     1       5.545   4.819   0.242  1.00  0.00           C  
HETATM   35  C   UNL     1       4.617   3.104   1.803  1.00  0.00           C  
HETATM   36  C   UNL     1       3.920   5.494   2.015  1.00  0.00           C  
HETATM   37  C   UNL     1       7.938  -2.713   4.314  1.00  0.00           C  
HETATM   38  F   UNL     1       4.885  -0.360  -3.756  1.00  0.00           F  
HETATM   39  F   UNL     1       5.547  -2.545  -3.839  1.00  0.00           F  
HETATM   40  F   UNL     1       3.322  -2.026  -3.808  1.00  0.00           F  
HETATM   41  N   UNL     1      -0.390   0.989  -0.983  1.00  0.00           N  
HETATM   42  N   UNL     1      -3.454  -0.137  -2.241  1.00  0.00           N  
HETATM   43  N   UNL     1       1.016   3.393  -0.154  1.00  0.00           N  
HETATM   44  N   UNL     1       3.400  -1.506   0.199  1.00  0.00           N  
HETATM   45  N   UNL     1       5.709  -1.997  -1.195  1.00  0.00           N  
HETATM   46  N   UNL     1      -4.462  -2.253  -0.222  1.00  0.00           N  
HETATM   47  O   UNL     1       2.273  -1.167  -1.792  1.00  0.00           O  
HETATM   48  O   UNL     1      -2.594  -0.654  -0.248  1.00  0.00           O  
HETATM   49  O   UNL     1      -2.142   2.336  -0.832  1.00  0.00           O  
HETATM   50  O   UNL     1       3.208   4.148   0.114  1.00  0.00           O  
HETATM   51  O   UNL     1       1.928   3.644   1.855  1.00  0.00           O  
HETATM   52  O   UNL     1      -5.242  -0.377   0.670  1.00  0.00           O  
HETATM   53  O   UNL     1      -3.741  -2.134   2.099  1.00  0.00           O  
HETATM   54  O   UNL     1      -3.982  -4.320   0.968  1.00  0.00           O  
HETATM   55  O   UNL     1       8.021  -2.682   2.888  1.00  0.00           O  
HETATM   56  S   UNL     1      -4.463  -3.013   1.249  1.00  0.00           S  
HETATM   57  H   UNL     1      -5.376   1.758  -2.459  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.116   2.528   1.385  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.736   2.880   0.831  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.524   3.947   2.239  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.034   0.383  -2.888  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.707  -2.070  -1.305  1.00  0.00           H  
HETATM   63  H   UNL     1       0.116  -1.593  -2.817  1.00  0.00           H  
HETATM   64  H   UNL     1       1.140  -1.490  -0.084  1.00  0.00           H  
HETATM   65  H   UNL     1       1.217   0.764   0.351  1.00  0.00           H  
HETATM   66  H   UNL     1       1.676   1.148  -1.329  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.830  -1.012  -2.237  1.00  0.00           H  
HETATM   68  H   UNL     1      -5.792  -0.440  -3.651  1.00  0.00           H  
HETATM   69  H   UNL     1      -0.627   4.926   1.381  1.00  0.00           H  
HETATM   70  H   UNL     1      -1.210   4.826  -0.298  1.00  0.00           H  
HETATM   71  H   UNL     1      -3.499   5.808   1.112  1.00  0.00           H  
HETATM   72  H   UNL     1      -3.342   5.029  -0.480  1.00  0.00           H  
HETATM   73  H   UNL     1       3.640  -1.654   2.829  1.00  0.00           H  
HETATM   74  H   UNL     1       7.814  -2.542   0.309  1.00  0.00           H  
HETATM   75  H   UNL     1       5.709  -2.180   3.999  1.00  0.00           H  
HETATM   76  H   UNL     1      -5.734  -4.124   3.658  1.00  0.00           H  
HETATM   77  H   UNL     1      -7.385  -3.302   3.636  1.00  0.00           H  
HETATM   78  H   UNL     1      -7.944  -4.484   1.462  1.00  0.00           H  
HETATM   79  H   UNL     1      -6.293  -5.306   1.485  1.00  0.00           H  
HETATM   80  H   UNL     1      -6.966  -1.074   2.033  1.00  0.00           H  
HETATM   81  H   UNL     1      -6.698  -1.506   0.328  1.00  0.00           H  
HETATM   82  H   UNL     1      -8.098  -2.169   1.204  1.00  0.00           H  
HETATM   83  H   UNL     1      -7.515   0.697  -0.484  1.00  0.00           H  
HETATM   84  H   UNL     1      -7.013   2.645   0.821  1.00  0.00           H  
HETATM   85  H   UNL     1      -4.288   2.546  -0.400  1.00  0.00           H  
HETATM   86  H   UNL     1      -5.317   3.681  -1.307  1.00  0.00           H  
HETATM   87  H   UNL     1      -5.032   3.796   1.719  1.00  0.00           H  
HETATM   88  H   UNL     1      -5.693   5.039   0.630  1.00  0.00           H  
HETATM   89  H   UNL     1       5.821   4.031  -0.460  1.00  0.00           H  
HETATM   90  H   UNL     1       5.325   5.734  -0.308  1.00  0.00           H  
HETATM   91  H   UNL     1       6.371   4.999   0.930  1.00  0.00           H  
HETATM   92  H   UNL     1       3.732   2.791   2.358  1.00  0.00           H  
HETATM   93  H   UNL     1       4.903   2.319   1.103  1.00  0.00           H  
HETATM   94  H   UNL     1       5.436   3.286   2.498  1.00  0.00           H  
HETATM   95  H   UNL     1       4.745   5.673   2.703  1.00  0.00           H  
HETATM   96  H   UNL     1       3.699   6.409   1.465  1.00  0.00           H  
HETATM   97  H   UNL     1       3.038   5.187   2.577  1.00  0.00           H  
HETATM   98  H   UNL     1       7.621  -1.737   4.681  1.00  0.00           H  
HETATM   99  H   UNL     1       7.215  -3.469   4.620  1.00  0.00           H  
HETATM  100  H   UNL     1       8.916  -2.957   4.729  1.00  0.00           H  
HETATM  101  H   UNL     1      -3.327   0.040  -3.187  1.00  0.00           H  
HETATM  102  H   UNL     1       1.131   3.397  -1.117  1.00  0.00           H  
HETATM  103  H   UNL     1      -4.182  -2.734  -1.016  1.00  0.00           H  
CONECT    1   29   14   12   57                                       
CONECT    2   15   11   43   58                                       
CONECT    3   17   15   59   60                                       
CONECT    4   47   44   44   18                                       
CONECT    5   19   45   21   21                                       
CONECT    6    8   41    7   61                                       
CONECT    7    6    9   62   63                                       
CONECT    8   48   48   42    6                                       
CONECT    9    7   10   47   64                                       
CONECT   10   41    9   65   66                                       
CONECT   11   49   49    2   41                                       
CONECT   12    1   13   14   42                                       
CONECT   13   52   52   12   46                                       
CONECT   14    1   12   67   68                                       
CONECT   15    3    2   69   70                                       
CONECT   16   43   50   51   51                                       
CONECT   17   32    3   71   72                                       
CONECT   18    4   22   45   45                                       
CONECT   19   44   20   20    5                                       
CONECT   20   19   19   23   73                                       
CONECT   21    5    5   24   74                                       
CONECT   22   40   39   18   38                                       
CONECT   23   20   24   24   75                                       
CONECT   24   23   23   21   55                                       
CONECT   25   56   27   28   26                                       
CONECT   26   27   25   76   77                                       
CONECT   27   25   26   78   79                                       
CONECT   28   25   80   81   82                                       
CONECT   29   30   30    1   83                                       
CONECT   30   29   29   31   84                                       
CONECT   31   30   32   85   86                                       
CONECT   32   31   17   87   88                                       
CONECT   33   50   34   35   36                                       
CONECT   34   33   89   90   91                                       
CONECT   35   33   92   93   94                                       
CONECT   36   33   95   96   97                                       
CONECT   37   55   98   99  100                                       
CONECT   38   22                                                      
CONECT   39   22                                                      
CONECT   40   22                                                      
CONECT   41   11    6   10                                            
CONECT   42   12    8  101                                            
CONECT   43    2   16  102                                            
CONECT   44    4    4   19                                            
CONECT   45   18   18    5                                            
CONECT   46   13   56  103                                            
CONECT   47    9    4                                                 
CONECT   48    8    8                                                 
CONECT   49   11   11                                                 
CONECT   50   16   33                                                 
CONECT   51   16   16                                                 
CONECT   52   13   13                                                 
CONECT   53   56   56                                                 
CONECT   54   56   56                                                 
CONECT   55   24   37                                                 
CONECT   56   53   53   54   54                                       
CONECT   56   46   25                                                 
CONECT   57    1                                                      
CONECT   58    2                                                      
CONECT   59    3                                                      
CONECT   60    3                                                      
CONECT   61    6                                                      
CONECT   62    7                                                      
CONECT   63    7                                                      
CONECT   64    9                                                      
CONECT   65   10                                                      
CONECT   66   10                                                      
CONECT   67   14                                                      
CONECT   68   14                                                      
CONECT   69   15                                                      
CONECT   70   15                                                      
CONECT   71   17                                                      
CONECT   72   17                                                      
CONECT   73   20                                                      
CONECT   74   21                                                      
CONECT   75   23                                                      
CONECT   76   26                                                      
CONECT   77   26                                                      
CONECT   78   27                                                      
CONECT   79   27                                                      
CONECT   80   28                                                      
CONECT   81   28                                                      
CONECT   82   28                                                      
CONECT   83   29                                                      
CONECT   84   30                                                      
CONECT   85   31                                                      
CONECT   86   31                                                      
CONECT   87   32                                                      
CONECT   88   32                                                      
CONECT   89   34                                                      
CONECT   90   34                                                      
CONECT   91   34                                                      
CONECT   92   35                                                      
CONECT   93   35                                                      
CONECT   94   35                                                      
CONECT   95   36                                                      
CONECT   96   36                                                      
CONECT   97   36                                                      
CONECT   98   37                                                      
CONECT   99   37                                                      
CONECT  100   37                                                      
CONECT  101   42                                                      
CONECT  102   43                                                      
CONECT  103   46                                                      
MASTER        0    0    0    0    0    0    0    0  103    0  103    0
END
