COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.798  -0.721  -3.340  1.00  0.00           C  
HETATM    2  C   UNL     1       2.289   0.276  -4.391  1.00  0.00           C  
HETATM    3  C   UNL     1       2.303   1.662  -3.799  1.00  0.00           C  
HETATM    4  C   UNL     1       3.415   2.354  -3.776  1.00  0.00           C  
HETATM    5  C   UNL     1       3.429   3.738  -3.180  1.00  0.00           C  
HETATM    6  C   UNL     1       4.631   3.878  -2.244  1.00  0.00           C  
HETATM    7  C   UNL     1       4.235   3.432  -0.835  1.00  0.00           C  
HETATM    8  C   UNL     1       2.797   2.910  -0.850  1.00  0.00           C  
HETATM    9  C   UNL     1       5.052   2.014   0.897  1.00  0.00           C  
HETATM   10  C   UNL     1       5.948   0.924   1.428  1.00  0.00           C  
HETATM   11  C   UNL     1       5.090  -0.218   1.978  1.00  0.00           C  
HETATM   12  C   UNL     1       3.394   0.753   3.343  1.00  0.00           C  
HETATM   13  C   UNL     1       1.970   1.159   3.624  1.00  0.00           C  
HETATM   14  C   UNL     1       5.117  -1.394   1.000  1.00  0.00           C  
HETATM   15  C   UNL     1       7.142  -1.367  -0.281  1.00  0.00           C  
HETATM   16  C   UNL     1       3.684  -1.831   0.690  1.00  0.00           C  
HETATM   17  C   UNL     1       3.671  -2.663  -0.595  1.00  0.00           C  
HETATM   18  C   UNL     1       3.522  -4.144  -0.242  1.00  0.00           C  
HETATM   19  C   UNL     1       3.634  -4.985  -1.515  1.00  0.00           C  
HETATM   20  C   UNL     1       2.497  -2.226  -1.472  1.00  0.00           C  
HETATM   21  C   UNL     1       2.986  -1.218  -2.514  1.00  0.00           C  
HETATM   22  C   UNL     1       4.003  -1.891  -3.437  1.00  0.00           C  
HETATM   23  O   UNL     1       0.854  -0.081  -2.480  1.00  0.00           O  
HETATM   24  O   UNL     1       5.129   2.377  -0.392  1.00  0.00           O  
HETATM   25  O   UNL     1       4.265   2.561   1.633  1.00  0.00           O  
HETATM   26  O   UNL     1       3.723   0.242   2.146  1.00  0.00           O  
HETATM   27  O   UNL     1       4.240   0.889   4.194  1.00  0.00           O  
HETATM   28  O   UNL     1       5.765  -0.993  -0.209  1.00  0.00           O  
HETATM   29  O   UNL     1       3.495  -6.369  -1.186  1.00  0.00           O  
HETATM   30  C   UNL     1       1.545  -0.815   1.060  1.00  0.00           C  
HETATM   31  C   UNL     1       0.632   0.260   0.465  1.00  0.00           C  
HETATM   32  C   UNL     1      -0.789   0.068   1.005  1.00  0.00           C  
HETATM   33  C   UNL     1      -1.264  -1.349   0.668  1.00  0.00           C  
HETATM   34  C   UNL     1      -0.277  -2.362   1.255  1.00  0.00           C  
HETATM   35  C   UNL     1      -0.712  -3.778   0.872  1.00  0.00           C  
HETATM   36  C   UNL     1      -2.065   0.630  -0.975  1.00  0.00           C  
HETATM   37  O   UNL     1       2.860  -0.677   0.518  1.00  0.00           O  
HETATM   38  O   UNL     1       1.113   1.554   0.836  1.00  0.00           O  
HETATM   39  N   UNL     1      -1.688   1.049   0.382  1.00  0.00           N  
HETATM   40  O   UNL     1       1.030  -2.108   0.736  1.00  0.00           O  
HETATM   41  C   UNL     1      -3.338  -2.543   0.536  1.00  0.00           C  
HETATM   42  C   UNL     1      -4.541  -2.939   1.395  1.00  0.00           C  
HETATM   43  C   UNL     1      -5.430  -1.711   1.615  1.00  0.00           C  
HETATM   44  C   UNL     1      -5.848  -1.148   0.253  1.00  0.00           C  
HETATM   45  C   UNL     1      -4.594  -0.820  -0.562  1.00  0.00           C  
HETATM   46  C   UNL     1      -5.003  -0.313  -1.946  1.00  0.00           C  
HETATM   47  C   UNL     1      -6.674  -2.114   2.408  1.00  0.00           C  
HETATM   48  O   UNL     1      -2.561  -1.563   1.229  1.00  0.00           O  
HETATM   49  O   UNL     1      -4.702  -0.718   2.339  1.00  0.00           O  
HETATM   50  O   UNL     1      -6.630   0.060   0.447  1.00  0.00           O  
HETATM   51  O   UNL     1      -3.797  -1.998  -0.702  1.00  0.00           O  
HETATM   52  C   UNL     1      -7.556   0.343  -0.483  1.00  0.00           C  
HETATM   53  C   UNL     1      -8.406   1.580  -0.348  1.00  0.00           C  
HETATM   54  C   UNL     1      -9.373   1.665  -1.531  1.00  0.00           C  
HETATM   55  C   UNL     1     -10.354   0.492  -1.472  1.00  0.00           C  
HETATM   56  C   UNL     1     -10.149   2.982  -1.461  1.00  0.00           C  
HETATM   57  O   UNL     1      -7.708  -0.395  -1.427  1.00  0.00           O  
HETATM   58  C   UNL     1      -2.878   1.274   1.213  1.00  0.00           C  
HETATM   59  P   UNL     1       0.137   2.793   1.160  1.00  0.00           P  
HETATM   60  O   UNL     1      -0.767   2.431   2.275  1.00  0.00           O  
HETATM   61  O   UNL     1       1.017   4.075   1.576  1.00  0.00           O  
HETATM   62  O   UNL     1      -0.737   3.143  -0.147  1.00  0.00           O  
HETATM   63  H   UNL     1       1.322  -1.567  -3.836  1.00  0.00           H  
HETATM   64  H   UNL     1       3.297   0.006  -4.707  1.00  0.00           H  
HETATM   65  H   UNL     1       1.621   0.256  -5.252  1.00  0.00           H  
HETATM   66  H   UNL     1       1.396   2.086  -3.395  1.00  0.00           H  
HETATM   67  H   UNL     1       4.323   1.932  -4.182  1.00  0.00           H  
HETATM   68  H   UNL     1       3.503   4.476  -3.979  1.00  0.00           H  
HETATM   69  H   UNL     1       2.510   3.901  -2.618  1.00  0.00           H  
HETATM   70  H   UNL     1       5.448   3.255  -2.606  1.00  0.00           H  
HETATM   71  H   UNL     1       4.952   4.920  -2.218  1.00  0.00           H  
HETATM   72  H   UNL     1       4.306   4.279  -0.152  1.00  0.00           H  
HETATM   73  H   UNL     1       2.550   2.496   0.127  1.00  0.00           H  
HETATM   74  H   UNL     1       2.115   3.728  -1.081  1.00  0.00           H  
HETATM   75  H   UNL     1       2.701   2.133  -1.609  1.00  0.00           H  
HETATM   76  H   UNL     1       6.578   0.548   0.622  1.00  0.00           H  
HETATM   77  H   UNL     1       6.575   1.324   2.224  1.00  0.00           H  
HETATM   78  H   UNL     1       5.487  -0.537   2.942  1.00  0.00           H  
HETATM   79  H   UNL     1       1.877   1.460   4.667  1.00  0.00           H  
HETATM   80  H   UNL     1       1.696   1.993   2.979  1.00  0.00           H  
HETATM   81  H   UNL     1       1.308   0.316   3.428  1.00  0.00           H  
HETATM   82  H   UNL     1       5.662  -2.225   1.447  1.00  0.00           H  
HETATM   83  H   UNL     1       7.669  -0.985   0.594  1.00  0.00           H  
HETATM   84  H   UNL     1       7.223  -2.454  -0.308  1.00  0.00           H  
HETATM   85  H   UNL     1       7.586  -0.947  -1.184  1.00  0.00           H  
HETATM   86  H   UNL     1       3.301  -2.432   1.515  1.00  0.00           H  
HETATM   87  H   UNL     1       4.605  -2.510  -1.135  1.00  0.00           H  
HETATM   88  H   UNL     1       4.309  -4.433   0.455  1.00  0.00           H  
HETATM   89  H   UNL     1       2.549  -4.311   0.220  1.00  0.00           H  
HETATM   90  H   UNL     1       2.848  -4.696  -2.212  1.00  0.00           H  
HETATM   91  H   UNL     1       4.608  -4.818  -1.976  1.00  0.00           H  
HETATM   92  H   UNL     1       2.078  -3.096  -1.977  1.00  0.00           H  
HETATM   93  H   UNL     1       1.731  -1.763  -0.850  1.00  0.00           H  
HETATM   94  H   UNL     1       3.456  -0.373  -2.010  1.00  0.00           H  
HETATM   95  H   UNL     1       4.422  -1.150  -4.118  1.00  0.00           H  
HETATM   96  H   UNL     1       4.804  -2.328  -2.839  1.00  0.00           H  
HETATM   97  H   UNL     1       3.510  -2.675  -4.011  1.00  0.00           H  
HETATM   98  H   UNL     1       0.073   0.259  -2.937  1.00  0.00           H  
HETATM   99  H   UNL     1       3.556  -6.962  -1.946  1.00  0.00           H  
HETATM  100  H   UNL     1       1.584  -0.700   2.143  1.00  0.00           H  
HETATM  101  H   UNL     1       0.625   0.172  -0.621  1.00  0.00           H  
HETATM  102  H   UNL     1      -0.790   0.208   2.086  1.00  0.00           H  
HETATM  103  H   UNL     1      -1.310  -1.470  -0.414  1.00  0.00           H  
HETATM  104  H   UNL     1      -0.262  -2.267   2.341  1.00  0.00           H  
HETATM  105  H   UNL     1      -0.818  -3.845  -0.211  1.00  0.00           H  
HETATM  106  H   UNL     1       0.039  -4.492   1.209  1.00  0.00           H  
HETATM  107  H   UNL     1      -1.668  -4.005   1.345  1.00  0.00           H  
HETATM  108  H   UNL     1      -2.519  -0.360  -0.937  1.00  0.00           H  
HETATM  109  H   UNL     1      -2.779   1.342  -1.390  1.00  0.00           H  
HETATM  110  H   UNL     1      -1.176   0.598  -1.605  1.00  0.00           H  
HETATM  111  H   UNL     1      -2.724  -3.422   0.342  1.00  0.00           H  
HETATM  112  H   UNL     1      -5.112  -3.716   0.886  1.00  0.00           H  
HETATM  113  H   UNL     1      -4.194  -3.315   2.358  1.00  0.00           H  
HETATM  114  H   UNL     1      -6.445  -1.888  -0.280  1.00  0.00           H  
HETATM  115  H   UNL     1      -4.017  -0.050  -0.049  1.00  0.00           H  
HETATM  116  H   UNL     1      -5.611   0.585  -1.839  1.00  0.00           H  
HETATM  117  H   UNL     1      -4.110  -0.080  -2.526  1.00  0.00           H  
HETATM  118  H   UNL     1      -5.579  -1.083  -2.460  1.00  0.00           H  
HETATM  119  H   UNL     1      -6.374  -2.521   3.373  1.00  0.00           H  
HETATM  120  H   UNL     1      -7.306  -1.239   2.563  1.00  0.00           H  
HETATM  121  H   UNL     1      -7.230  -2.869   1.852  1.00  0.00           H  
HETATM  122  H   UNL     1      -4.399  -1.009   3.211  1.00  0.00           H  
HETATM  123  H   UNL     1      -8.972   1.532   0.582  1.00  0.00           H  
HETATM  124  H   UNL     1      -7.765   2.462  -0.339  1.00  0.00           H  
HETATM  125  H   UNL     1      -8.811   1.623  -2.464  1.00  0.00           H  
HETATM  126  H   UNL     1     -11.043   0.553  -2.315  1.00  0.00           H  
HETATM  127  H   UNL     1      -9.802  -0.446  -1.522  1.00  0.00           H  
HETATM  128  H   UNL     1     -10.916   0.534  -0.539  1.00  0.00           H  
HETATM  129  H   UNL     1      -9.450   3.818  -1.503  1.00  0.00           H  
HETATM  130  H   UNL     1     -10.838   3.043  -2.303  1.00  0.00           H  
HETATM  131  H   UNL     1     -10.711   3.024  -0.528  1.00  0.00           H  
HETATM  132  H   UNL     1      -2.572   1.626   2.198  1.00  0.00           H  
HETATM  133  H   UNL     1      -3.514   2.023   0.741  1.00  0.00           H  
HETATM  134  H   UNL     1      -3.431   0.341   1.316  1.00  0.00           H  
HETATM  135  H   UNL     1       0.499   4.881   1.711  1.00  0.00           H  
HETATM  136  H   UNL     1      -0.209   3.315  -0.939  1.00  0.00           H  
CONECT    1    2   23   21   63                                       
CONECT    2    3    1   64   65                                       
CONECT    3    4    4    2   66                                       
CONECT    4    5    3    3   67                                       
CONECT    5    6    4   68   69                                       
CONECT    6    7    5   70   71                                       
CONECT    7    8   24    6   72                                       
CONECT    8    7   73   74   75                                       
CONECT    9   25   25   24   10                                       
CONECT   10    9   11   76   77                                       
CONECT   11   26   10   14   78                                       
CONECT   12   13   27   27   26                                       
CONECT   13   12   79   80   81                                       
CONECT   14   11   28   16   82                                       
CONECT   15   28   83   84   85                                       
CONECT   16   14   17   37   86                                       
CONECT   17   16   18   20   87                                       
CONECT   18   19   17   88   89                                       
CONECT   19   29   18   90   91                                       
CONECT   20   17   21   92   93                                       
CONECT   21    1   20   22   94                                       
CONECT   22   21   95   96   97                                       
CONECT   23    1   98                                                 
CONECT   24    9    7                                                 
CONECT   25    9    9                                                 
CONECT   26   12   11                                                 
CONECT   27   12   12                                                 
CONECT   28   14   15                                                 
CONECT   29   19   99                                                 
CONECT   30   40   37   31  100                                       
CONECT   31   30   32   38  101                                       
CONECT   32   33   31   39  102                                       
CONECT   33   48   34   32  103                                       
CONECT   34   35   33   40  104                                       
CONECT   35   34  105  106  107                                       
CONECT   36   39  108  109  110                                       
CONECT   37   30   16                                                 
CONECT   38   31   59                                                 
CONECT   39   32   58   36                                            
CONECT   40   34   30                                                 
CONECT   41   51   42   48  111                                       
CONECT   42   43   41  112  113                                       
CONECT   43   44   47   42   49                                       
CONECT   44   50   45   43  114                                       
CONECT   45   46   44   51  115                                       
CONECT   46   45  116  117  118                                       
CONECT   47   43  119  120  121                                       
CONECT   48   41   33                                                 
CONECT   49   43  122                                                 
CONECT   50   52   44                                                 
CONECT   51   45   41                                                 
CONECT   52   57   57   53   50                                       
CONECT   53   52   54  123  124                                       
CONECT   54   53   56   55  125                                       
CONECT   55   54  126  127  128                                       
CONECT   56   54  129  130  131                                       
CONECT   57   52   52                                                 
CONECT   58   39  132  133  134                                       
CONECT   59   38   60   60   62                                       
CONECT   59   61                                                      
CONECT   60   59   59                                                 
CONECT   61   59  135                                                 
CONECT   62   59  136                                                 
CONECT   63    1                                                      
CONECT   64    2                                                      
CONECT   65    2                                                      
CONECT   66    3                                                      
CONECT   67    4                                                      
CONECT   68    5                                                      
CONECT   69    5                                                      
CONECT   70    6                                                      
CONECT   71    6                                                      
CONECT   72    7                                                      
CONECT   73    8                                                      
CONECT   74    8                                                      
CONECT   75    8                                                      
CONECT   76   10                                                      
CONECT   77   10                                                      
CONECT   78   11                                                      
CONECT   79   13                                                      
CONECT   80   13                                                      
CONECT   81   13                                                      
CONECT   82   14                                                      
CONECT   83   15                                                      
CONECT   84   15                                                      
CONECT   85   15                                                      
CONECT   86   16                                                      
CONECT   87   17                                                      
CONECT   88   18                                                      
CONECT   89   18                                                      
CONECT   90   19                                                      
CONECT   91   19                                                      
CONECT   92   20                                                      
CONECT   93   20                                                      
CONECT   94   21                                                      
CONECT   95   22                                                      
CONECT   96   22                                                      
CONECT   97   22                                                      
CONECT   98   23                                                      
CONECT   99   29                                                      
CONECT  100   30                                                      
CONECT  101   31                                                      
CONECT  102   32                                                      
CONECT  103   33                                                      
CONECT  104   34                                                      
CONECT  105   35                                                      
CONECT  106   35                                                      
CONECT  107   35                                                      
CONECT  108   36                                                      
CONECT  109   36                                                      
CONECT  110   36                                                      
CONECT  111   41                                                      
CONECT  112   42                                                      
CONECT  113   42                                                      
CONECT  114   44                                                      
CONECT  115   45                                                      
CONECT  116   46                                                      
CONECT  117   46                                                      
CONECT  118   46                                                      
CONECT  119   47                                                      
CONECT  120   47                                                      
CONECT  121   47                                                      
CONECT  122   49                                                      
CONECT  123   53                                                      
CONECT  124   53                                                      
CONECT  125   54                                                      
CONECT  126   55                                                      
CONECT  127   55                                                      
CONECT  128   55                                                      
CONECT  129   56                                                      
CONECT  130   56                                                      
CONECT  131   56                                                      
CONECT  132   58                                                      
CONECT  133   58                                                      
CONECT  134   58                                                      
CONECT  135   61                                                      
CONECT  136   62                                                      
MASTER        0    0    0    0    0    0    0    0  136    0  136    0
END
