COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      11.093  -0.935   1.117  1.00  0.00           C  
HETATM    2  C   UNL     1       9.864  -0.101   0.863  1.00  0.00           C  
HETATM    3  C   UNL     1       9.614   0.620  -0.249  1.00  0.00           C  
HETATM    4  C   UNL     1       5.484   0.397   1.265  1.00  0.00           C  
HETATM    5  C   UNL     1       5.802  -1.443   3.000  1.00  0.00           C  
HETATM    6  C   UNL     1       5.098  -1.007   4.259  1.00  0.00           C  
HETATM    7  C   UNL     1       2.722  -0.564  -0.963  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.584  -0.041   0.559  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.106  -1.854  -0.505  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.867  -3.475  -1.623  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.445  -4.469  -2.597  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.142   2.444   0.446  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.916   3.873  -0.533  1.00  0.00           C  
HETATM   14  N   UNL     1       8.811   0.050   1.715  1.00  0.00           N  
HETATM   15  C   UNL     1      10.173  -0.345  -2.442  1.00  0.00           C  
HETATM   16  C   UNL     1       0.988   1.209  -0.393  1.00  0.00           C  
HETATM   17  C   UNL     1       1.735   2.400  -0.937  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.922  -0.723   0.206  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.281  -3.112  -0.410  1.00  0.00           C  
HETATM   20  C   UNL     1       5.150  -0.791   1.808  1.00  0.00           C  
HETATM   21  C   UNL     1       4.078  -1.312   1.055  1.00  0.00           C  
HETATM   22  C   UNL     1       3.799  -0.421   0.082  1.00  0.00           C  
HETATM   23  C   UNL     1       1.412  -0.071  -0.404  1.00  0.00           C  
HETATM   24  C   UNL     1       2.596   2.992   0.149  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.281   1.228   0.217  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.850  -0.494   1.240  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.141  -3.041  -1.393  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.214  -1.646  -1.350  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.662  -0.394  -1.127  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.793  -2.640  -2.324  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.055   2.657  -0.763  1.00  0.00           C  
HETATM   32  C   UNL     1       3.375  -2.623   1.294  1.00  0.00           C  
HETATM   33  C   UNL     1       2.201  -2.405   2.250  1.00  0.00           C  
HETATM   34  C   UNL     1       1.497  -3.716   2.489  1.00  0.00           C  
HETATM   35  C   UNL     1       7.669   2.144  -1.064  1.00  0.00           C  
HETATM   36  C   UNL     1       6.789   1.306  -1.995  1.00  0.00           C  
HETATM   37  C   UNL     1      10.511   0.741  -1.454  1.00  0.00           C  
HETATM   38  C   UNL     1       6.098   2.211  -2.982  1.00  0.00           C  
HETATM   39  C   UNL     1      -5.835   0.260  -1.810  1.00  0.00           C  
HETATM   40  C   UNL     1      -7.107  -0.114  -1.093  1.00  0.00           C  
HETATM   41  C   UNL     1      -7.615   0.508  -0.009  1.00  0.00           C  
HETATM   42  C   UNL     1      -8.807  -0.158   0.338  1.00  0.00           C  
HETATM   43  C   UNL     1      -8.982  -1.161  -0.547  1.00  0.00           C  
HETATM   44  C   UNL     1      -7.017   1.695   0.700  1.00  0.00           C  
HETATM   45  C   UNL     1      -7.552   2.966   0.090  1.00  0.00           C  
HETATM   46  C   UNL     1      -9.719   0.188   1.487  1.00  0.00           C  
HETATM   47  C   UNL     1     -11.607   1.629   2.202  1.00  0.00           C  
HETATM   48  C   UNL     1     -10.695   1.283   1.053  1.00  0.00           C  
HETATM   49  C   UNL     1       8.360   1.239  -0.077  1.00  0.00           C  
HETATM   50  C   UNL     1       7.894   0.877   1.136  1.00  0.00           C  
HETATM   51  C   UNL     1       6.585   1.309   1.744  1.00  0.00           C  
HETATM   52  N   UNL     1      -3.873   0.178  -0.173  1.00  0.00           N  
HETATM   53  N   UNL     1       0.450  -0.843   0.177  1.00  0.00           N  
HETATM   54  N   UNL     1       4.658   0.630   0.206  1.00  0.00           N  
HETATM   55  N   UNL     1      -7.945  -1.135  -1.431  1.00  0.00           N  
HETATM   56  O   UNL     1      10.849  -0.433  -3.599  1.00  0.00           O  
HETATM   57  O   UNL     1      -6.040  -4.505  -3.735  1.00  0.00           O  
HETATM   58  O   UNL     1      -2.811   4.503   0.492  1.00  0.00           O  
HETATM   59  O   UNL     1      -3.801   4.255  -1.468  1.00  0.00           O  
HETATM   60  O   UNL     1       0.429  -3.766   3.301  1.00  0.00           O  
HETATM   61  O   UNL     1       1.894  -4.721   1.950  1.00  0.00           O  
HETATM   62  O   UNL     1       6.290   3.403  -2.945  1.00  0.00           O  
HETATM   63  O   UNL     1       5.270   1.692  -3.902  1.00  0.00           O  
HETATM   64  O   UNL     1     -11.489   1.057   3.259  1.00  0.00           O  
HETATM   65  O   UNL     1     -12.550   2.572   2.050  1.00  0.00           O  
HETATM   66  O   UNL     1      -7.155   4.157   0.566  1.00  0.00           O  
HETATM   67  O   UNL     1       9.295  -1.136  -2.194  1.00  0.00           O  
HETATM   68  O   UNL     1      -8.338   2.912  -0.826  1.00  0.00           O  
HETATM   69  O   UNL     1       5.510  -1.465   5.451  1.00  0.00           O  
HETATM   70  O   UNL     1       4.162  -0.246   4.194  1.00  0.00           O  
HETATM   71  O   UNL     1       3.355   4.068  -0.108  1.00  0.00           O  
HETATM   72  O   UNL     1       2.602   2.497   1.252  1.00  0.00           O  
HETATM   73  O   UNL     1      -0.270  -4.058  -1.484  1.00  0.00           O  
HETATM   74  O   UNL     1      -1.012  -2.069  -2.099  1.00  0.00           O  
HETATM   75  O   UNL     1      -7.411  -5.313  -2.201  1.00  0.00           O  
HETATM   76  H   UNL     1      10.927  -1.948   0.751  1.00  0.00           H  
HETATM   77  H   UNL     1      11.944  -0.495   0.597  1.00  0.00           H  
HETATM   78  H   UNL     1      11.297  -0.964   2.188  1.00  0.00           H  
HETATM   79  H   UNL     1       6.850  -1.145   3.048  1.00  0.00           H  
HETATM   80  H   UNL     1       5.736  -2.526   2.903  1.00  0.00           H  
HETATM   81  H   UNL     1       2.987   0.025  -1.840  1.00  0.00           H  
HETATM   82  H   UNL     1       2.625  -1.612  -1.244  1.00  0.00           H  
HETATM   83  H   UNL     1      -6.658  -2.818  -1.261  1.00  0.00           H  
HETATM   84  H   UNL     1      -5.422  -4.007  -0.782  1.00  0.00           H  
HETATM   85  H   UNL     1      -1.750   2.295   1.339  1.00  0.00           H  
HETATM   86  H   UNL     1      -0.507   3.319   0.581  1.00  0.00           H  
HETATM   87  H   UNL     1       8.726  -0.363   2.589  1.00  0.00           H  
HETATM   88  H   UNL     1       2.365   2.085  -1.769  1.00  0.00           H  
HETATM   89  H   UNL     1       1.022   3.148  -1.284  1.00  0.00           H  
HETATM   90  H   UNL     1      -1.884  -3.210   0.601  1.00  0.00           H  
HETATM   91  H   UNL     1      -2.906  -3.975  -0.640  1.00  0.00           H  
HETATM   92  H   UNL     1      -1.660  -1.423   1.778  1.00  0.00           H  
HETATM   93  H   UNL     1      -2.180   0.272   1.941  1.00  0.00           H  
HETATM   94  H   UNL     1      -4.002  -3.296  -2.686  1.00  0.00           H  
HETATM   95  H   UNL     1      -5.237  -2.108  -3.165  1.00  0.00           H  
HETATM   96  H   UNL     1      -1.447   2.806  -1.655  1.00  0.00           H  
HETATM   97  H   UNL     1      -2.691   1.782  -0.898  1.00  0.00           H  
HETATM   98  H   UNL     1       3.004  -3.014   0.347  1.00  0.00           H  
HETATM   99  H   UNL     1       4.073  -3.335   1.733  1.00  0.00           H  
HETATM  100  H   UNL     1       2.571  -2.013   3.198  1.00  0.00           H  
HETATM  101  H   UNL     1       1.502  -1.692   1.811  1.00  0.00           H  
HETATM  102  H   UNL     1       8.415   2.677  -1.653  1.00  0.00           H  
HETATM  103  H   UNL     1       7.049   2.862  -0.527  1.00  0.00           H  
HETATM  104  H   UNL     1       7.409   0.588  -2.532  1.00  0.00           H  
HETATM  105  H   UNL     1       6.043   0.773  -1.406  1.00  0.00           H  
HETATM  106  H   UNL     1      10.363   1.715  -1.920  1.00  0.00           H  
HETATM  107  H   UNL     1      11.551   0.641  -1.144  1.00  0.00           H  
HETATM  108  H   UNL     1      -5.711   1.342  -1.789  1.00  0.00           H  
HETATM  109  H   UNL     1      -5.889  -0.080  -2.845  1.00  0.00           H  
HETATM  110  H   UNL     1      -9.805  -1.860  -0.555  1.00  0.00           H  
HETATM  111  H   UNL     1      -7.283   1.659   1.756  1.00  0.00           H  
HETATM  112  H   UNL     1      -5.932   1.672   0.597  1.00  0.00           H  
HETATM  113  H   UNL     1     -10.279  -0.699   1.786  1.00  0.00           H  
HETATM  114  H   UNL     1      -9.125   0.543   2.329  1.00  0.00           H  
HETATM  115  H   UNL     1     -10.135   2.170   0.754  1.00  0.00           H  
HETATM  116  H   UNL     1     -11.289   0.928   0.211  1.00  0.00           H  
HETATM  117  H   UNL     1       6.365   2.333   1.444  1.00  0.00           H  
HETATM  118  H   UNL     1       6.654   1.256   2.831  1.00  0.00           H  
HETATM  119  H   UNL     1      -3.973   1.076   0.180  1.00  0.00           H  
HETATM  120  H   UNL     1       0.495  -1.804   0.301  1.00  0.00           H  
HETATM  121  H   UNL     1       4.678   1.413  -0.365  1.00  0.00           H  
HETATM  122  H   UNL     1      -7.822  -1.744  -2.175  1.00  0.00           H  
HETATM  123  H   UNL     1      10.597  -1.147  -4.201  1.00  0.00           H  
HETATM  124  H   UNL     1      -4.331   5.041  -1.276  1.00  0.00           H  
HETATM  125  H   UNL     1       0.011  -4.630   3.423  1.00  0.00           H  
HETATM  126  H   UNL     1       4.850   2.312  -4.514  1.00  0.00           H  
HETATM  127  H   UNL     1     -13.111   2.758   2.815  1.00  0.00           H  
HETATM  128  H   UNL     1      -7.525   4.944   0.142  1.00  0.00           H  
HETATM  129  H   UNL     1       5.027  -1.158   6.230  1.00  0.00           H  
HETATM  130  H   UNL     1       3.891   4.412   0.620  1.00  0.00           H  
HETATM  131  H   UNL     1       0.445  -3.967  -2.129  1.00  0.00           H  
HETATM  132  H   UNL     1      -7.750  -5.932  -2.861  1.00  0.00           H  
CONECT    1    2   76   77   78                                       
CONECT    2    3    3   14    1                                       
CONECT    3   37   49    2    2                                       
CONECT    4   51   54   20   20                                       
CONECT    5    6   20   79   80                                       
CONECT    6   70   70   69    5                                       
CONECT    7   22   23   81   82                                       
CONECT    8   53   25   25   26                                       
CONECT    9   18   18   19   28                                       
CONECT   10   30   11   83   84                                       
CONECT   11   10   57   57   75                                       
CONECT   12   25   31   85   86                                       
CONECT   13   31   58   58   59                                       
CONECT   14   50    2   87                                            
CONECT   15   37   67   67   56                                       
CONECT   16   17   23   23   25                                       
CONECT   17   24   16   88   89                                       
CONECT   18   26   52    9    9                                       
CONECT   19    9   27   90   91                                       
CONECT   20    4    4    5   21                                       
CONECT   21   22   22   20   32                                       
CONECT   22   54    7   21   21                                       
CONECT   23    7   16   16   53                                       
CONECT   24   72   72   71   17                                       
CONECT   25   16   12    8    8                                       
CONECT   26    8   18   92   93                                       
CONECT   27   19   74   74   73                                       
CONECT   28   29   29    9   30                                       
CONECT   29   52   39   28   28                                       
CONECT   30   28   10   94   95                                       
CONECT   31   12   13   96   97                                       
CONECT   32   21   33   98   99                                       
CONECT   33   32   34  100  101                                       
CONECT   34   33   61   61   60                                       
CONECT   35   36   49  102  103                                       
CONECT   36   38   35  104  105                                       
CONECT   37    3   15  106  107                                       
CONECT   38   62   62   63   36                                       
CONECT   39   29   40  108  109                                       
CONECT   40   39   55   41   41                                       
CONECT   41   40   40   42   44                                       
CONECT   42   43   43   41   46                                       
CONECT   43   55   42   42  110                                       
CONECT   44   41   45  111  112                                       
CONECT   45   44   68   68   66                                       
CONECT   46   42   48  113  114                                       
CONECT   47   64   64   65   48                                       
CONECT   48   47   46  115  116                                       
CONECT   49   35    3   50   50                                       
CONECT   50   49   49   51   14                                       
CONECT   51   50    4  117  118                                       
CONECT   52   18   29  119                                            
CONECT   53   23    8  120                                            
CONECT   54    4   22  121                                            
CONECT   55   40   43  122                                            
CONECT   56   15  123                                                 
CONECT   57   11   11                                                 
CONECT   58   13   13                                                 
CONECT   59   13  124                                                 
CONECT   60   34  125                                                 
CONECT   61   34   34                                                 
CONECT   62   38   38                                                 
CONECT   63   38  126                                                 
CONECT   64   47   47                                                 
CONECT   65   47  127                                                 
CONECT   66   45  128                                                 
CONECT   67   15   15                                                 
CONECT   68   45   45                                                 
CONECT   69    6  129                                                 
CONECT   70    6    6                                                 
CONECT   71   24  130                                                 
CONECT   72   24   24                                                 
CONECT   73   27  131                                                 
CONECT   74   27   27                                                 
CONECT   75   11  132                                                 
CONECT   76    1                                                      
CONECT   77    1                                                      
CONECT   78    1                                                      
CONECT   79    5                                                      
CONECT   80    5                                                      
CONECT   81    7                                                      
CONECT   82    7                                                      
CONECT   83   10                                                      
CONECT   84   10                                                      
CONECT   85   12                                                      
CONECT   86   12                                                      
CONECT   87   14                                                      
CONECT   88   17                                                      
CONECT   89   17                                                      
CONECT   90   19                                                      
CONECT   91   19                                                      
CONECT   92   26                                                      
CONECT   93   26                                                      
CONECT   94   30                                                      
CONECT   95   30                                                      
CONECT   96   31                                                      
CONECT   97   31                                                      
CONECT   98   32                                                      
CONECT   99   32                                                      
CONECT  100   33                                                      
CONECT  101   33                                                      
CONECT  102   35                                                      
CONECT  103   35                                                      
CONECT  104   36                                                      
CONECT  105   36                                                      
CONECT  106   37                                                      
CONECT  107   37                                                      
CONECT  108   39                                                      
CONECT  109   39                                                      
CONECT  110   43                                                      
CONECT  111   44                                                      
CONECT  112   44                                                      
CONECT  113   46                                                      
CONECT  114   46                                                      
CONECT  115   48                                                      
CONECT  116   48                                                      
CONECT  117   51                                                      
CONECT  118   51                                                      
CONECT  119   52                                                      
CONECT  120   53                                                      
CONECT  121   54                                                      
CONECT  122   55                                                      
CONECT  123   56                                                      
CONECT  124   59                                                      
CONECT  125   60                                                      
CONECT  126   63                                                      
CONECT  127   65                                                      
CONECT  128   66                                                      
CONECT  129   69                                                      
CONECT  130   71                                                      
CONECT  131   73                                                      
CONECT  132   75                                                      
MASTER        0    0    0    0    0    0    0    0  132    0  132    0
END
