COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.287   0.814   1.103  1.00  0.00           C  
HETATM    2  C   UNL     1       7.094   1.596  -1.043  1.00  0.00           C  
HETATM    3  C   UNL     1      10.014   3.816  -1.897  1.00  0.00           C  
HETATM    4  C   UNL     1       6.882  -0.567   0.820  1.00  0.00           C  
HETATM    5  C   UNL     1       6.077  -1.630   1.574  1.00  0.00           C  
HETATM    6  C   UNL     1       1.928  -3.150  -0.550  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.230  -0.902   0.065  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.105   1.310   0.700  1.00  0.00           C  
HETATM    9  C   UNL     1       0.028  -5.253  -3.674  1.00  0.00           C  
HETATM   10  C   UNL     1       0.851  -4.557  -2.588  1.00  0.00           C  
HETATM   11  C   UNL     1       0.571  -3.038  -0.780  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.208  -2.211   0.032  1.00  0.00           C  
HETATM   13  C   UNL     1       0.381  -1.501   1.072  1.00  0.00           C  
HETATM   14  C   UNL     1       1.734  -1.610   1.306  1.00  0.00           C  
HETATM   15  C   UNL     1       2.517  -2.440   0.500  1.00  0.00           C  
HETATM   16  C   UNL     1       3.967  -2.558   0.749  1.00  0.00           C  
HETATM   17  C   UNL     1       4.012  -0.187   1.357  1.00  0.00           C  
HETATM   18  C   UNL     1       4.840   0.860   0.605  1.00  0.00           C  
HETATM   19  C   UNL     1       7.858   2.725  -1.737  1.00  0.00           C  
HETATM   20  C   UNL     1       9.207   3.034   0.248  1.00  0.00           C  
HETATM   21  C   UNL     1       8.443   1.904   0.943  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.485   1.410   0.598  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.160   3.150   0.317  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.861   2.587  -0.842  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.096   1.219  -0.946  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.201   0.287   0.183  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.466  -0.510   0.793  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.123  -1.991   0.560  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.716  -2.570   1.931  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.399  -1.633   2.957  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.256  -0.239   2.297  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.805   0.719  -2.029  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.252   1.573  -3.018  1.00  0.00           C  
HETATM   34  C   UNL     1      -6.996   2.932  -2.935  1.00  0.00           C  
HETATM   35  C   UNL     1      -6.310   3.434  -1.861  1.00  0.00           C  
HETATM   36  C   UNL     1      -3.588   3.331   2.089  1.00  0.00           C  
HETATM   37  N   UNL     1       4.660  -1.497   1.210  1.00  0.00           N  
HETATM   38  N   UNL     1       7.077   1.838   0.407  1.00  0.00           N  
HETATM   39  N   UNL     1       9.225   2.791  -1.201  1.00  0.00           N  
HETATM   40  N   UNL     1      -1.578  -2.098  -0.200  1.00  0.00           N  
HETATM   41  N   UNL     1      -1.518   0.155   0.422  1.00  0.00           N  
HETATM   42  N   UNL     1      -4.122   2.605   0.934  1.00  0.00           N  
HETATM   43  N   UNL     1      -5.576   0.342   0.001  1.00  0.00           N  
HETATM   44  N   UNL     1      -3.549  -0.847  -0.052  1.00  0.00           N  
HETATM   45  O   UNL     1      -0.006  -3.731  -1.797  1.00  0.00           O  
HETATM   46  O   UNL     1       4.536  -3.611   0.539  1.00  0.00           O  
HETATM   47  O   UNL     1      -5.567   4.211   0.750  1.00  0.00           O  
HETATM   48  H   UNL     1       6.308   1.006   2.175  1.00  0.00           H  
HETATM   49  H   UNL     1       6.071   1.564  -1.418  1.00  0.00           H  
HETATM   50  H   UNL     1       7.586   0.645  -1.246  1.00  0.00           H  
HETATM   51  H   UNL     1       9.541   4.789  -1.769  1.00  0.00           H  
HETATM   52  H   UNL     1      11.021   3.843  -1.481  1.00  0.00           H  
HETATM   53  H   UNL     1      10.067   3.574  -2.959  1.00  0.00           H  
HETATM   54  H   UNL     1       6.838  -0.770  -0.250  1.00  0.00           H  
HETATM   55  H   UNL     1       7.919  -0.592   1.153  1.00  0.00           H  
HETATM   56  H   UNL     1       6.433  -2.623   1.299  1.00  0.00           H  
HETATM   57  H   UNL     1       6.193  -1.482   2.648  1.00  0.00           H  
HETATM   58  H   UNL     1       2.531  -3.789  -1.178  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.516   2.164   1.001  1.00  0.00           H  
HETATM   60  H   UNL     1       0.682  -5.883  -4.277  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.742  -5.869  -3.209  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.442  -4.503  -4.310  1.00  0.00           H  
HETATM   63  H   UNL     1       1.321  -5.307  -1.952  1.00  0.00           H  
HETATM   64  H   UNL     1       1.620  -3.942  -3.053  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.224  -0.862   1.698  1.00  0.00           H  
HETATM   66  H   UNL     1       2.189  -1.057   2.114  1.00  0.00           H  
HETATM   67  H   UNL     1       3.960   0.079   2.413  1.00  0.00           H  
HETATM   68  H   UNL     1       3.006  -0.225   0.940  1.00  0.00           H  
HETATM   69  H   UNL     1       4.425   1.851   0.785  1.00  0.00           H  
HETATM   70  H   UNL     1       4.816   0.644  -0.463  1.00  0.00           H  
HETATM   71  H   UNL     1       7.897   2.532  -2.809  1.00  0.00           H  
HETATM   72  H   UNL     1       7.350   3.673  -1.557  1.00  0.00           H  
HETATM   73  H   UNL     1       8.715   3.985   0.452  1.00  0.00           H  
HETATM   74  H   UNL     1      10.230   3.067   0.624  1.00  0.00           H  
HETATM   75  H   UNL     1       8.951   0.957   0.762  1.00  0.00           H  
HETATM   76  H   UNL     1       8.404   2.097   2.015  1.00  0.00           H  
HETATM   77  H   UNL     1      -7.504  -0.319   0.521  1.00  0.00           H  
HETATM   78  H   UNL     1      -6.996  -2.520   0.176  1.00  0.00           H  
HETATM   79  H   UNL     1      -5.295  -2.077  -0.144  1.00  0.00           H  
HETATM   80  H   UNL     1      -6.085  -3.590   2.039  1.00  0.00           H  
HETATM   81  H   UNL     1      -4.633  -2.541   2.050  1.00  0.00           H  
HETATM   82  H   UNL     1      -7.450  -1.896   3.080  1.00  0.00           H  
HETATM   83  H   UNL     1      -5.878  -1.664   3.914  1.00  0.00           H  
HETATM   84  H   UNL     1      -5.260   0.167   2.476  1.00  0.00           H  
HETATM   85  H   UNL     1      -7.019   0.442   2.674  1.00  0.00           H  
HETATM   86  H   UNL     1      -7.008  -0.340  -2.098  1.00  0.00           H  
HETATM   87  H   UNL     1      -7.803   1.180  -3.860  1.00  0.00           H  
HETATM   88  H   UNL     1      -7.338   3.591  -3.719  1.00  0.00           H  
HETATM   89  H   UNL     1      -6.117   4.495  -1.804  1.00  0.00           H  
HETATM   90  H   UNL     1      -2.817   4.026   1.756  1.00  0.00           H  
HETATM   91  H   UNL     1      -4.392   3.886   2.573  1.00  0.00           H  
HETATM   92  H   UNL     1      -3.157   2.623   2.797  1.00  0.00           H  
HETATM   93  H   UNL     1      -2.075  -2.855  -0.547  1.00  0.00           H  
CONECT    1    4   38   18   48                                       
CONECT    2   38   19   49   50                                       
CONECT    3   39   51   52   53                                       
CONECT    4    5    1   54   55                                       
CONECT    5    4   37   56   57                                       
CONECT    6   15   11   11   58                                       
CONECT    7   40   44   44   41                                       
CONECT    8   41   41   22   59                                       
CONECT    9   10   60   61   62                                       
CONECT   10   45    9   63   64                                       
CONECT   11    6    6   12   45                                       
CONECT   12   13   13   11   40                                       
CONECT   13   14   12   12   65                                       
CONECT   14   15   15   13   66                                       
CONECT   15   16   14   14    6                                       
CONECT   16   46   46   37   15                                       
CONECT   17   37   18   67   68                                       
CONECT   18    1   17   69   70                                       
CONECT   19   39    2   71   72                                       
CONECT   20   21   39   73   74                                       
CONECT   21   20   38   75   76                                       
CONECT   22   26   26    8   42                                       
CONECT   23   24   42   47   47                                       
CONECT   24   25   23   35   35                                       
CONECT   25   43   32   32   24                                       
CONECT   26   43   44   22   22                                       
CONECT   27   31   28   43   77                                       
CONECT   28   29   27   78   79                                       
CONECT   29   30   28   80   81                                       
CONECT   30   29   31   82   83                                       
CONECT   31   30   27   84   85                                       
CONECT   32   25   25   33   86                                       
CONECT   33   32   34   34   87                                       
CONECT   34   33   33   35   88                                       
CONECT   35   24   24   34   89                                       
CONECT   36   42   90   91   92                                       
CONECT   37    5   16   17                                            
CONECT   38   21    1    2                                            
CONECT   39   20    3   19                                            
CONECT   40   12    7   93                                            
CONECT   41    7    8    8                                            
CONECT   42   22   23   36                                            
CONECT   43   27   26   25                                            
CONECT   44    7    7   26                                            
CONECT   45   11   10                                                 
CONECT   46   16   16                                                 
CONECT   47   23   23                                                 
CONECT   48    1                                                      
CONECT   49    2                                                      
CONECT   50    2                                                      
CONECT   51    3                                                      
CONECT   52    3                                                      
CONECT   53    3                                                      
CONECT   54    4                                                      
CONECT   55    4                                                      
CONECT   56    5                                                      
CONECT   57    5                                                      
CONECT   58    6                                                      
CONECT   59    8                                                      
CONECT   60    9                                                      
CONECT   61    9                                                      
CONECT   62    9                                                      
CONECT   63   10                                                      
CONECT   64   10                                                      
CONECT   65   13                                                      
CONECT   66   14                                                      
CONECT   67   17                                                      
CONECT   68   17                                                      
CONECT   69   18                                                      
CONECT   70   18                                                      
CONECT   71   19                                                      
CONECT   72   19                                                      
CONECT   73   20                                                      
CONECT   74   20                                                      
CONECT   75   21                                                      
CONECT   76   21                                                      
CONECT   77   27                                                      
CONECT   78   28                                                      
CONECT   79   28                                                      
CONECT   80   29                                                      
CONECT   81   29                                                      
CONECT   82   30                                                      
CONECT   83   30                                                      
CONECT   84   31                                                      
CONECT   85   31                                                      
CONECT   86   32                                                      
CONECT   87   33                                                      
CONECT   88   34                                                      
CONECT   89   35                                                      
CONECT   90   36                                                      
CONECT   91   36                                                      
CONECT   92   36                                                      
CONECT   93   40                                                      
MASTER        0    0    0    0    0    0    0    0   93    0   93    0
END
