COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      14.596  -4.535   1.372  1.00  0.00           C  
HETATM    2  C   UNL     1      13.633  -4.072   0.277  1.00  0.00           C  
HETATM    3  C   UNL     1      12.330  -3.586   0.915  1.00  0.00           C  
HETATM    4  C   UNL     1      11.368  -3.123  -0.180  1.00  0.00           C  
HETATM    5  C   UNL     1      10.065  -2.638   0.458  1.00  0.00           C  
HETATM    6  C   UNL     1       9.102  -2.175  -0.637  1.00  0.00           C  
HETATM    7  C   UNL     1       7.799  -1.689   0.001  1.00  0.00           C  
HETATM    8  C   UNL     1       6.836  -1.226  -1.094  1.00  0.00           C  
HETATM    9  C   UNL     1       5.533  -0.740  -0.456  1.00  0.00           C  
HETATM   10  C   UNL     1       4.570  -0.277  -1.551  1.00  0.00           C  
HETATM   11  C   UNL     1       3.267   0.208  -0.913  1.00  0.00           C  
HETATM   12  C   UNL     1       2.319   0.664  -1.992  1.00  0.00           C  
HETATM   13  C   UNL     1       0.245   1.556  -2.755  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.086   2.057  -2.190  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.821   3.159  -1.162  1.00  0.00           C  
HETATM   16  C   UNL     1       1.967   3.138   3.321  1.00  0.00           C  
HETATM   17  C   UNL     1       2.767   2.028   4.006  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.128   1.003  -1.557  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.922  -0.103  -0.912  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.417   0.191  -1.057  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.223  -0.932  -0.403  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.718  -0.638  -0.548  1.00  0.00           C  
HETATM   23  C   UNL     1      -8.525  -1.761   0.106  1.00  0.00           C  
HETATM   24  C   UNL     1     -10.019  -1.467  -0.039  1.00  0.00           C  
HETATM   25  C   UNL     1     -10.826  -2.590   0.615  1.00  0.00           C  
HETATM   26  C   UNL     1     -12.321  -2.296   0.470  1.00  0.00           C  
HETATM   27  C   UNL     1     -13.127  -3.419   1.124  1.00  0.00           C  
HETATM   28  C   UNL     1     -14.622  -3.125   0.979  1.00  0.00           C  
HETATM   29  C   UNL     1     -15.429  -4.248   1.633  1.00  0.00           C  
HETATM   30  N   UNL     1       3.956   1.714   3.203  1.00  0.00           N  
HETATM   31  O   UNL     1       2.651   0.607  -3.152  1.00  0.00           O  
HETATM   32  O   UNL     1       1.105   1.134  -1.664  1.00  0.00           O  
HETATM   33  O   UNL     1       0.075   2.671  -0.161  1.00  0.00           O  
HETATM   34  O   UNL     1       1.460   4.794   0.535  1.00  0.00           O  
HETATM   35  O   UNL     1      -0.600   4.091   1.813  1.00  0.00           O  
HETATM   36  O   UNL     1       1.464   2.660   2.071  1.00  0.00           O  
HETATM   37  O   UNL     1      -1.786   0.957  -1.551  1.00  0.00           O  
HETATM   38  O   UNL     1      -3.698   1.932  -2.078  1.00  0.00           O  
HETATM   39  P   UNL     1       0.574   3.566   1.081  1.00  0.00           P  
HETATM   40  H   UNL     1      14.809  -3.703   2.044  1.00  0.00           H  
HETATM   41  H   UNL     1      14.141  -5.350   1.935  1.00  0.00           H  
HETATM   42  H   UNL     1      15.524  -4.881   0.918  1.00  0.00           H  
HETATM   43  H   UNL     1      14.088  -3.257  -0.286  1.00  0.00           H  
HETATM   44  H   UNL     1      13.421  -4.903  -0.395  1.00  0.00           H  
HETATM   45  H   UNL     1      11.876  -4.401   1.478  1.00  0.00           H  
HETATM   46  H   UNL     1      12.543  -2.755   1.587  1.00  0.00           H  
HETATM   47  H   UNL     1      11.823  -2.308  -0.743  1.00  0.00           H  
HETATM   48  H   UNL     1      11.155  -3.954  -0.852  1.00  0.00           H  
HETATM   49  H   UNL     1       9.610  -3.453   1.021  1.00  0.00           H  
HETATM   50  H   UNL     1      10.277  -1.806   1.130  1.00  0.00           H  
HETATM   51  H   UNL     1       9.557  -1.359  -1.200  1.00  0.00           H  
HETATM   52  H   UNL     1       8.889  -3.006  -1.309  1.00  0.00           H  
HETATM   53  H   UNL     1       7.344  -2.504   0.564  1.00  0.00           H  
HETATM   54  H   UNL     1       8.011  -0.858   0.673  1.00  0.00           H  
HETATM   55  H   UNL     1       7.291  -0.411  -1.657  1.00  0.00           H  
HETATM   56  H   UNL     1       6.624  -2.057  -1.766  1.00  0.00           H  
HETATM   57  H   UNL     1       5.078  -1.556   0.107  1.00  0.00           H  
HETATM   58  H   UNL     1       5.746   0.091   0.216  1.00  0.00           H  
HETATM   59  H   UNL     1       5.025   0.538  -2.114  1.00  0.00           H  
HETATM   60  H   UNL     1       4.358  -1.109  -2.224  1.00  0.00           H  
HETATM   61  H   UNL     1       2.813  -0.607  -0.350  1.00  0.00           H  
HETATM   62  H   UNL     1       3.480   1.040  -0.241  1.00  0.00           H  
HETATM   63  H   UNL     1       0.062   0.712  -3.420  1.00  0.00           H  
HETATM   64  H   UNL     1       0.729   2.358  -3.311  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.697   2.456  -3.000  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.375   4.020  -1.659  1.00  0.00           H  
HETATM   67  H   UNL     1      -1.760   3.454  -0.695  1.00  0.00           H  
HETATM   68  H   UNL     1       1.134   3.432   3.959  1.00  0.00           H  
HETATM   69  H   UNL     1       2.614   3.998   3.147  1.00  0.00           H  
HETATM   70  H   UNL     1       3.075   2.361   4.997  1.00  0.00           H  
HETATM   71  H   UNL     1       2.146   1.137   4.099  1.00  0.00           H  
HETATM   72  H   UNL     1      -3.689  -1.049  -1.401  1.00  0.00           H  
HETATM   73  H   UNL     1      -3.665  -0.167   0.145  1.00  0.00           H  
HETATM   74  H   UNL     1      -5.650   1.138  -0.569  1.00  0.00           H  
HETATM   75  H   UNL     1      -5.674   0.255  -2.115  1.00  0.00           H  
HETATM   76  H   UNL     1      -5.991  -1.878  -0.891  1.00  0.00           H  
HETATM   77  H   UNL     1      -5.967  -0.996   0.654  1.00  0.00           H  
HETATM   78  H   UNL     1      -7.951   0.308  -0.060  1.00  0.00           H  
HETATM   79  H   UNL     1      -7.975  -0.574  -1.606  1.00  0.00           H  
HETATM   80  H   UNL     1      -8.292  -2.707  -0.382  1.00  0.00           H  
HETATM   81  H   UNL     1      -8.268  -1.825   1.163  1.00  0.00           H  
HETATM   82  H   UNL     1     -10.252  -0.521   0.449  1.00  0.00           H  
HETATM   83  H   UNL     1     -10.276  -1.403  -1.097  1.00  0.00           H  
HETATM   84  H   UNL     1     -10.593  -3.537   0.127  1.00  0.00           H  
HETATM   85  H   UNL     1     -10.569  -2.654   1.672  1.00  0.00           H  
HETATM   86  H   UNL     1     -12.553  -1.350   0.958  1.00  0.00           H  
HETATM   87  H   UNL     1     -12.577  -2.232  -0.588  1.00  0.00           H  
HETATM   88  H   UNL     1     -12.894  -4.366   0.636  1.00  0.00           H  
HETATM   89  H   UNL     1     -12.870  -3.483   2.181  1.00  0.00           H  
HETATM   90  H   UNL     1     -14.855  -2.179   1.467  1.00  0.00           H  
HETATM   91  H   UNL     1     -14.879  -3.061  -0.079  1.00  0.00           H  
HETATM   92  H   UNL     1     -16.493  -4.039   1.530  1.00  0.00           H  
HETATM   93  H   UNL     1     -15.196  -5.195   1.145  1.00  0.00           H  
HETATM   94  H   UNL     1     -15.172  -4.312   2.690  1.00  0.00           H  
HETATM   95  H   UNL     1       4.501   0.983   3.634  1.00  0.00           H  
HETATM   96  H   UNL     1       3.699   1.464   2.259  1.00  0.00           H  
HETATM   97  H   UNL     1       2.248   4.523   0.044  1.00  0.00           H  
CONECT    1    2   40   41   42                                       
CONECT    2    1    3   43   44                                       
CONECT    3    2    4   45   46                                       
CONECT    4    3    5   47   48                                       
CONECT    5    4    6   49   50                                       
CONECT    6    5    7   51   52                                       
CONECT    7    6    8   53   54                                       
CONECT    8    7    9   55   56                                       
CONECT    9    8   10   57   58                                       
CONECT   10    9   11   59   60                                       
CONECT   11   10   12   61   62                                       
CONECT   12   11   31   31   32                                       
CONECT   13   32   14   63   64                                       
CONECT   14   13   37   15   65                                       
CONECT   15   14   33   66   67                                       
CONECT   16   36   17   68   69                                       
CONECT   17   16   30   70   71                                       
CONECT   18   19   37   38   38                                       
CONECT   19   20   18   72   73                                       
CONECT   20   21   19   74   75                                       
CONECT   21   22   20   76   77                                       
CONECT   22   23   21   78   79                                       
CONECT   23   24   22   80   81                                       
CONECT   24   25   23   82   83                                       
CONECT   25   26   24   84   85                                       
CONECT   26   27   25   86   87                                       
CONECT   27   28   26   88   89                                       
CONECT   28   29   27   90   91                                       
CONECT   29   28   92   93   94                                       
CONECT   30   17   95   96                                            
CONECT   31   12   12                                                 
CONECT   32   12   13                                                 
CONECT   33   15   39                                                 
CONECT   34   39   97                                                 
CONECT   35   39   39                                                 
CONECT   36   39   16                                                 
CONECT   37   14   18                                                 
CONECT   38   18   18                                                 
CONECT   39   33   35   35   36                                       
CONECT   39   34                                                      
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    1                                                      
CONECT   43    2                                                      
CONECT   44    2                                                      
CONECT   45    3                                                      
CONECT   46    3                                                      
CONECT   47    4                                                      
CONECT   48    4                                                      
CONECT   49    5                                                      
CONECT   50    5                                                      
CONECT   51    6                                                      
CONECT   52    6                                                      
CONECT   53    7                                                      
CONECT   54    7                                                      
CONECT   55    8                                                      
CONECT   56    8                                                      
CONECT   57    9                                                      
CONECT   58    9                                                      
CONECT   59   10                                                      
CONECT   60   10                                                      
CONECT   61   11                                                      
CONECT   62   11                                                      
CONECT   63   13                                                      
CONECT   64   13                                                      
CONECT   65   14                                                      
CONECT   66   15                                                      
CONECT   67   15                                                      
CONECT   68   16                                                      
CONECT   69   16                                                      
CONECT   70   17                                                      
CONECT   71   17                                                      
CONECT   72   19                                                      
CONECT   73   19                                                      
CONECT   74   20                                                      
CONECT   75   20                                                      
CONECT   76   21                                                      
CONECT   77   21                                                      
CONECT   78   22                                                      
CONECT   79   22                                                      
CONECT   80   23                                                      
CONECT   81   23                                                      
CONECT   82   24                                                      
CONECT   83   24                                                      
CONECT   84   25                                                      
CONECT   85   25                                                      
CONECT   86   26                                                      
CONECT   87   26                                                      
CONECT   88   27                                                      
CONECT   89   27                                                      
CONECT   90   28                                                      
CONECT   91   28                                                      
CONECT   92   29                                                      
CONECT   93   29                                                      
CONECT   94   29                                                      
CONECT   95   30                                                      
CONECT   96   30                                                      
CONECT   97   34                                                      
MASTER        0    0    0    0    0    0    0    0   97    0   97    0
END
