COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.852   1.134  -0.018  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.291  -0.859  -1.222  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.153   0.689   0.118  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.590  -1.309  -1.089  1.00  0.00           C  
HETATM    5  C   UNL     1       1.106   4.004  -1.694  1.00  0.00           C  
HETATM    6  C   UNL     1       2.838   4.272  -0.052  1.00  0.00           C  
HETATM    7  C   UNL     1       0.243   3.568  -0.709  1.00  0.00           C  
HETATM    8  C   UNL     1       1.970   3.835   0.930  1.00  0.00           C  
HETATM    9  C   UNL     1       4.227  -3.369   2.326  1.00  0.00           C  
HETATM   10  C   UNL     1       3.308  -2.424   2.743  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.922   0.361  -0.687  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.526  -0.535  -0.418  1.00  0.00           C  
HETATM   13  C   UNL     1       2.408   4.357  -1.368  1.00  0.00           C  
HETATM   14  C   UNL     1       0.674   3.483   0.602  1.00  0.00           C  
HETATM   15  C   UNL     1       4.165  -3.804   0.996  1.00  0.00           C  
HETATM   16  C   UNL     1       2.374  -1.962   1.814  1.00  0.00           C  
HETATM   17  C   UNL     1       5.125  -4.813   0.500  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.401   0.703   0.389  1.00  0.00           C  
HETATM   19  C   UNL     1       2.082   0.184   2.733  1.00  0.00           C  
HETATM   20  C   UNL     1       1.013   1.126   3.299  1.00  0.00           C  
HETATM   21  C   UNL     1       0.549  -0.680   1.064  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.582   0.226   1.561  1.00  0.00           C  
HETATM   23  C   UNL     1       6.804  -4.732  -3.107  1.00  0.00           C  
HETATM   24  C   UNL     1       5.496  -7.633  -0.942  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.504   0.849  -0.833  1.00  0.00           C  
HETATM   26  C   UNL     1       6.169  -6.087  -2.786  1.00  0.00           C  
HETATM   27  C   UNL     1       6.014  -6.231  -1.271  1.00  0.00           C  
HETATM   28  C   UNL     1      -9.116  -2.245  -0.863  1.00  0.00           C  
HETATM   29  C   UNL     1       4.584   5.133  -1.928  1.00  0.00           C  
HETATM   30  N   UNL     1       3.240  -3.308   0.182  1.00  0.00           N  
HETATM   31  N   UNL     1       2.388  -2.431   0.571  1.00  0.00           N  
HETATM   32  N   UNL     1       1.433  -1.016   2.188  1.00  0.00           N  
HETATM   33  N   UNL     1       0.013   1.381   2.251  1.00  0.00           N  
HETATM   34  N   UNL     1       5.063  -5.231  -0.780  1.00  0.00           N  
HETATM   35  N   UNL     1      -2.708   0.385   0.306  1.00  0.00           N  
HETATM   36  O   UNL     1       5.970  -5.266   1.247  1.00  0.00           O  
HETATM   37  O   UNL     1      -0.883   1.373  -0.479  1.00  0.00           O  
HETATM   38  O   UNL     1      -0.169   3.724   3.004  1.00  0.00           O  
HETATM   39  O   UNL     1      -1.713   2.835   1.252  1.00  0.00           O  
HETATM   40  O   UNL     1      -8.804  -0.975  -0.286  1.00  0.00           O  
HETATM   41  O   UNL     1       3.260   4.786  -2.336  1.00  0.00           O  
HETATM   42  F   UNL     1      -8.317  -3.232  -0.278  1.00  0.00           F  
HETATM   43  F   UNL     1     -10.465  -2.541  -0.636  1.00  0.00           F  
HETATM   44  F   UNL     1      -8.874  -2.203  -2.240  1.00  0.00           F  
HETATM   45  F   UNL     1       5.201   4.018  -1.351  1.00  0.00           F  
HETATM   46  F   UNL     1       5.321   5.551  -3.041  1.00  0.00           F  
HETATM   47  F   UNL     1       4.527   6.170  -0.990  1.00  0.00           F  
HETATM   48  S   UNL     1      -0.431   2.927   1.857  1.00  0.00           S  
HETATM   49  H   UNL     1      -5.563   2.089   0.396  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.562  -1.462  -1.744  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.879   1.294   0.641  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.878  -2.262  -1.508  1.00  0.00           H  
HETATM   53  H   UNL     1       0.770   4.066  -2.719  1.00  0.00           H  
HETATM   54  H   UNL     1       3.851   4.546   0.205  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.771   3.293  -0.962  1.00  0.00           H  
HETATM   56  H   UNL     1       2.305   3.768   1.955  1.00  0.00           H  
HETATM   57  H   UNL     1       4.974  -3.756   3.003  1.00  0.00           H  
HETATM   58  H   UNL     1       3.312  -2.055   3.758  1.00  0.00           H  
HETATM   59  H   UNL     1       2.632   0.692   1.940  1.00  0.00           H  
HETATM   60  H   UNL     1       2.770  -0.104   3.527  1.00  0.00           H  
HETATM   61  H   UNL     1       0.532   0.659   4.158  1.00  0.00           H  
HETATM   62  H   UNL     1       1.476   2.066   3.600  1.00  0.00           H  
HETATM   63  H   UNL     1       0.127  -1.595   0.647  1.00  0.00           H  
HETATM   64  H   UNL     1       1.120  -0.160   0.294  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.219  -0.328   2.251  1.00  0.00           H  
HETATM   66  H   UNL     1       6.914  -4.629  -4.187  1.00  0.00           H  
HETATM   67  H   UNL     1       6.166  -3.933  -2.729  1.00  0.00           H  
HETATM   68  H   UNL     1       7.784  -4.669  -2.634  1.00  0.00           H  
HETATM   69  H   UNL     1       6.203  -8.377  -1.308  1.00  0.00           H  
HETATM   70  H   UNL     1       5.385  -7.735   0.137  1.00  0.00           H  
HETATM   71  H   UNL     1       4.529  -7.784  -1.422  1.00  0.00           H  
HETATM   72  H   UNL     1      -3.078   0.457  -1.757  1.00  0.00           H  
HETATM   73  H   UNL     1      -3.495   1.938  -0.863  1.00  0.00           H  
HETATM   74  H   UNL     1       5.189  -6.150  -3.259  1.00  0.00           H  
HETATM   75  H   UNL     1       6.807  -6.885  -3.164  1.00  0.00           H  
HETATM   76  H   UNL     1       6.981  -6.079  -0.791  1.00  0.00           H  
HETATM   77  H   UNL     1       4.388  -4.869  -1.376  1.00  0.00           H  
HETATM   78  H   UNL     1      -3.122  -0.151   1.001  1.00  0.00           H  
CONECT    1    3    3   11   49                                       
CONECT    2    4   11   11   50                                       
CONECT    3    1    1   12   51                                       
CONECT    4    2   12   12   52                                       
CONECT    5    7    7   13   53                                       
CONECT    6    8   13   13   54                                       
CONECT    7    5    5   14   55                                       
CONECT    8    6   14   14   56                                       
CONECT    9   10   10   15   57                                       
CONECT   10    9    9   16   58                                       
CONECT   11    1    2    2   25                                       
CONECT   12    3    4    4   40                                       
CONECT   13    5    6    6   41                                       
CONECT   14    7    8    8   48                                       
CONECT   15    9   17   30   30                                       
CONECT   16   10   31   31   32                                       
CONECT   17   15   34   36   36                                       
CONECT   18   22   35   37   37                                       
CONECT   19   20   32   59   60                                       
CONECT   20   19   33   61   62                                       
CONECT   21   22   32   63   64                                       
CONECT   22   18   21   33   65                                       
CONECT   23   26   66   67   68                                       
CONECT   24   27   69   70   71                                       
CONECT   25   11   35   72   73                                       
CONECT   26   23   27   74   75                                       
CONECT   27   24   26   34   76                                       
CONECT   28   40   42   43   44                                       
CONECT   29   41   45   46   47                                       
CONECT   30   15   15   31                                            
CONECT   31   16   16   30                                            
CONECT   32   16   19   21                                            
CONECT   33   20   22   48                                            
CONECT   34   17   27   77                                            
CONECT   35   18   25   78                                            
CONECT   36   17   17                                                 
CONECT   37   18   18                                                 
CONECT   38   48   48                                                 
CONECT   39   48   48                                                 
CONECT   40   12   28                                                 
CONECT   41   13   29                                                 
CONECT   42   28                                                      
CONECT   43   28                                                      
CONECT   44   28                                                      
CONECT   45   29                                                      
CONECT   46   29                                                      
CONECT   47   29                                                      
CONECT   48   14   33   38   38                                       
CONECT   48   39   39                                                 
CONECT   49    1                                                      
CONECT   50    2                                                      
CONECT   51    3                                                      
CONECT   52    4                                                      
CONECT   53    5                                                      
CONECT   54    6                                                      
CONECT   55    7                                                      
CONECT   56    8                                                      
CONECT   57    9                                                      
CONECT   58   10                                                      
CONECT   59   19                                                      
CONECT   60   19                                                      
CONECT   61   20                                                      
CONECT   62   20                                                      
CONECT   63   21                                                      
CONECT   64   21                                                      
CONECT   65   22                                                      
CONECT   66   23                                                      
CONECT   67   23                                                      
CONECT   68   23                                                      
CONECT   69   24                                                      
CONECT   70   24                                                      
CONECT   71   24                                                      
CONECT   72   25                                                      
CONECT   73   25                                                      
CONECT   74   26                                                      
CONECT   75   26                                                      
CONECT   76   27                                                      
CONECT   77   34                                                      
CONECT   78   35                                                      
MASTER        0    0    0    0    0    0    0    0   78    0   78    0
END
