COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       9.988  -1.829  -1.960  1.00  0.00           C  
HETATM    2  N   UNL     1       9.729   0.218  -0.676  1.00  0.00           N  
HETATM    3  O   UNL     1       9.874  -2.393  -0.898  1.00  0.00           O  
HETATM    4  C   UNL     1       9.988  -0.323  -2.017  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.920  -7.191  -0.607  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.244  -5.889   0.127  1.00  0.00           C  
HETATM    7  C   UNL     1     -17.541   0.369   0.747  1.00  0.00           C  
HETATM    8  C   UNL     1     -18.948   0.856   0.396  1.00  0.00           C  
HETATM    9  O   UNL     1      14.486  -0.920   2.774  1.00  0.00           O  
HETATM   10  O   UNL     1      15.090   3.301   0.913  1.00  0.00           O  
HETATM   11  O   UNL     1       4.036  -1.156   0.781  1.00  0.00           O  
HETATM   12  O   UNL     1       5.727   2.389   0.877  1.00  0.00           O  
HETATM   13  O   UNL     1      -7.153   4.573  -0.748  1.00  0.00           O  
HETATM   14  O   UNL     1      -3.535   1.538   0.786  1.00  0.00           O  
HETATM   15  O   UNL     1       0.521   6.033  -1.814  1.00  0.00           O  
HETATM   16  O   UNL     1      14.778  -2.949   1.949  1.00  0.00           O  
HETATM   17  O   UNL     1      13.161   2.597   1.729  1.00  0.00           O  
HETATM   18  O   UNL     1       4.165  -3.083  -0.293  1.00  0.00           O  
HETATM   19  O   UNL     1       0.255   7.046   0.483  1.00  0.00           O  
HETATM   20  C   UNL     1     -16.513   1.401   0.277  1.00  0.00           C  
HETATM   21  C   UNL     1     -15.105   0.914   0.627  1.00  0.00           C  
HETATM   22  C   UNL     1     -14.077   1.945   0.157  1.00  0.00           C  
HETATM   23  C   UNL     1     -12.670   1.459   0.508  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.856  -4.698  -0.752  1.00  0.00           C  
HETATM   25  C   UNL     1     -11.642   2.490   0.038  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.180  -3.395  -0.018  1.00  0.00           C  
HETATM   27  C   UNL     1     -10.234   2.003   0.388  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.792  -2.204  -0.897  1.00  0.00           C  
HETATM   29  C   UNL     1      -9.207   3.034  -0.082  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.116  -0.902  -0.162  1.00  0.00           C  
HETATM   31  C   UNL     1       4.128   4.515   0.441  1.00  0.00           C  
HETATM   32  C   UNL     1       3.081   5.488  -0.106  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.799   2.548   0.268  1.00  0.00           C  
HETATM   34  C   UNL     1      -2.728   0.289  -1.041  1.00  0.00           C  
HETATM   35  C   UNL     1      10.800  -0.154   0.257  1.00  0.00           C  
HETATM   36  C   UNL     1       8.419  -0.219  -0.176  1.00  0.00           C  
HETATM   37  C   UNL     1      12.104   0.526  -0.165  1.00  0.00           C  
HETATM   38  C   UNL     1       7.315   0.580  -0.871  1.00  0.00           C  
HETATM   39  C   UNL     1      -4.559   4.368  -0.464  1.00  0.00           C  
HETATM   40  C   UNL     1      -2.165   5.078  -0.531  1.00  0.00           C  
HETATM   41  C   UNL     1      13.483  -1.280   0.673  1.00  0.00           C  
HETATM   42  C   UNL     1      14.378   0.966   0.541  1.00  0.00           C  
HETATM   43  C   UNL     1       5.754  -1.271  -0.827  1.00  0.00           C  
HETATM   44  C   UNL     1       4.931   1.006  -0.861  1.00  0.00           C  
HETATM   45  N   UNL     1       4.108   3.282  -0.350  1.00  0.00           N  
HETATM   46  O   UNL     1      -5.477   3.347   0.008  1.00  0.00           O  
HETATM   47  O   UNL     1       1.775   4.938   0.083  1.00  0.00           O  
HETATM   48  O   UNL     1      -0.837   4.734  -0.129  1.00  0.00           O  
HETATM   49  O   UNL     1      -2.789   2.753  -0.902  1.00  0.00           O  
HETATM   50  C   UNL     1      14.285  -1.703   1.876  1.00  0.00           C  
HETATM   51  C   UNL     1      14.165   2.348   1.105  1.00  0.00           C  
HETATM   52  C   UNL     1       4.589  -1.832  -0.054  1.00  0.00           C  
HETATM   53  C   UNL     1       4.952   2.275  -0.048  1.00  0.00           C  
HETATM   54  C   UNL     1      -6.786   3.564  -0.195  1.00  0.00           C  
HETATM   55  C   UNL     1      -3.047   1.572  -0.319  1.00  0.00           C  
HETATM   56  C   UNL     1      -3.123   3.948  -0.147  1.00  0.00           C  
HETATM   57  N   UNL     1      13.175   0.154   0.769  1.00  0.00           N  
HETATM   58  N   UNL     1       6.003   0.113  -0.402  1.00  0.00           N  
HETATM   59  P   UNL     1       0.430   5.695  -0.376  1.00  0.00           P  
HETATM   60  O   UNL     1      10.120  -2.543  -3.089  1.00  0.00           O  
HETATM   61  C   UNL     1     -19.976  -0.175   0.867  1.00  0.00           C  
HETATM   62  C   UNL     1     -21.384   0.312   0.516  1.00  0.00           C  
HETATM   63  C   UNL     1     -22.412  -0.720   0.986  1.00  0.00           C  
HETATM   64  C   UNL     1      -3.308  -8.382   0.272  1.00  0.00           C  
HETATM   65  C   UNL     1      -2.984  -9.685  -0.462  1.00  0.00           C  
HETATM   66  C   UNL     1      -3.372 -10.875   0.417  1.00  0.00           C  
HETATM   67  C   UNL     1      -3.049 -12.178  -0.317  1.00  0.00           C  
HETATM   68  C   UNL     1      -3.437 -13.369   0.562  1.00  0.00           C  
HETATM   69  C   UNL     1      -3.113 -14.672  -0.172  1.00  0.00           C  
HETATM   70  H   UNL     1       0.189   6.900   1.437  1.00  0.00           H  
HETATM   71  H   UNL     1      10.958   0.027  -2.369  1.00  0.00           H  
HETATM   72  H   UNL     1       9.209   0.015  -2.701  1.00  0.00           H  
HETATM   73  H   UNL     1      -3.481  -7.231  -1.541  1.00  0.00           H  
HETATM   74  H   UNL     1      -1.853  -7.231  -0.822  1.00  0.00           H  
HETATM   75  H   UNL     1      -4.312  -5.849   0.343  1.00  0.00           H  
HETATM   76  H   UNL     1      -2.684  -5.849   1.061  1.00  0.00           H  
HETATM   77  H   UNL     1     -17.459   0.241   1.826  1.00  0.00           H  
HETATM   78  H   UNL     1     -17.352  -0.583   0.252  1.00  0.00           H  
HETATM   79  H   UNL     1     -19.137   1.809   0.891  1.00  0.00           H  
HETATM   80  H   UNL     1     -19.030   0.985  -0.683  1.00  0.00           H  
HETATM   81  H   UNL     1      14.909   4.172   1.293  1.00  0.00           H  
HETATM   82  H   UNL     1      15.287  -3.175   2.740  1.00  0.00           H  
HETATM   83  H   UNL     1       3.414  -3.399   0.228  1.00  0.00           H  
HETATM   84  H   UNL     1     -16.595   1.529  -0.802  1.00  0.00           H  
HETATM   85  H   UNL     1     -16.702   2.353   0.772  1.00  0.00           H  
HETATM   86  H   UNL     1     -15.024   0.785   1.707  1.00  0.00           H  
HETATM   87  H   UNL     1     -14.917  -0.039   0.132  1.00  0.00           H  
HETATM   88  H   UNL     1     -14.159   2.074  -0.922  1.00  0.00           H  
HETATM   89  H   UNL     1     -14.266   2.898   0.652  1.00  0.00           H  
HETATM   90  H   UNL     1     -12.588   1.330   1.587  1.00  0.00           H  
HETATM   91  H   UNL     1     -12.481   0.506   0.013  1.00  0.00           H  
HETATM   92  H   UNL     1      -1.788  -4.738  -0.967  1.00  0.00           H  
HETATM   93  H   UNL     1      -3.417  -4.738  -1.686  1.00  0.00           H  
HETATM   94  H   UNL     1     -11.724   2.619  -1.042  1.00  0.00           H  
HETATM   95  H   UNL     1     -11.831   3.443   0.532  1.00  0.00           H  
HETATM   96  H   UNL     1      -4.248  -3.355   0.198  1.00  0.00           H  
HETATM   97  H   UNL     1      -2.620  -3.355   0.916  1.00  0.00           H  
HETATM   98  H   UNL     1     -10.153   1.875   1.467  1.00  0.00           H  
HETATM   99  H   UNL     1     -10.046   1.051  -0.107  1.00  0.00           H  
HETATM  100  H   UNL     1      -1.724  -2.244  -1.112  1.00  0.00           H  
HETATM  101  H   UNL     1      -3.353  -2.244  -1.831  1.00  0.00           H  
HETATM  102  H   UNL     1      -9.288   3.163  -1.161  1.00  0.00           H  
HETATM  103  H   UNL     1      -9.395   3.987   0.413  1.00  0.00           H  
HETATM  104  H   UNL     1      -4.184  -0.862   0.053  1.00  0.00           H  
HETATM  105  H   UNL     1      -2.556  -0.862   0.771  1.00  0.00           H  
HETATM  106  H   UNL     1       5.115   4.971   0.378  1.00  0.00           H  
HETATM  107  H   UNL     1       3.900   4.283   1.481  1.00  0.00           H  
HETATM  108  H   UNL     1       3.155   6.437   0.424  1.00  0.00           H  
HETATM  109  H   UNL     1       3.256   5.650  -1.169  1.00  0.00           H  
HETATM  110  H   UNL     1      -7.717   2.419   1.347  1.00  0.00           H  
HETATM  111  H   UNL     1      -7.610   1.595  -0.227  1.00  0.00           H  
HETATM  112  H   UNL     1      -1.660   0.249  -1.257  1.00  0.00           H  
HETATM  113  H   UNL     1      -3.289   0.249  -1.975  1.00  0.00           H  
HETATM  114  H   UNL     1      10.533   0.166   1.264  1.00  0.00           H  
HETATM  115  H   UNL     1      10.934  -1.236   0.244  1.00  0.00           H  
HETATM  116  H   UNL     1       8.286  -1.281  -0.385  1.00  0.00           H  
HETATM  117  H   UNL     1       8.367  -0.052   0.900  1.00  0.00           H  
HETATM  118  H   UNL     1      12.372   0.206  -1.171  1.00  0.00           H  
HETATM  119  H   UNL     1      11.970   1.608  -0.151  1.00  0.00           H  
HETATM  120  H   UNL     1       7.429   1.638  -0.636  1.00  0.00           H  
HETATM  121  H   UNL     1       7.387   0.437  -1.949  1.00  0.00           H  
HETATM  122  H   UNL     1      -4.673   4.489  -1.542  1.00  0.00           H  
HETATM  123  H   UNL     1      -4.780   5.313   0.032  1.00  0.00           H  
HETATM  124  H   UNL     1      -2.469   5.998  -0.032  1.00  0.00           H  
HETATM  125  H   UNL     1      -2.190   5.224  -1.611  1.00  0.00           H  
HETATM  126  H   UNL     1      14.059  -1.468  -0.233  1.00  0.00           H  
HETATM  127  H   UNL     1      12.554  -1.849   0.637  1.00  0.00           H  
HETATM  128  H   UNL     1      14.572   1.036  -0.529  1.00  0.00           H  
HETATM  129  H   UNL     1      15.230   0.500   1.036  1.00  0.00           H  
HETATM  130  H   UNL     1       6.641  -1.875  -0.637  1.00  0.00           H  
HETATM  131  H   UNL     1       5.525  -1.288  -1.893  1.00  0.00           H  
HETATM  132  H   UNL     1       3.968   0.511  -0.738  1.00  0.00           H  
HETATM  133  H   UNL     1       5.085   1.246  -1.913  1.00  0.00           H  
HETATM  134  H   UNL     1       3.488   3.190  -1.090  1.00  0.00           H  
HETATM  135  H   UNL     1      -3.032   3.741   0.919  1.00  0.00           H  
HETATM  136  H   UNL     1      10.118  -3.506  -3.001  1.00  0.00           H  
HETATM  137  H   UNL     1     -19.788  -1.128   0.372  1.00  0.00           H  
HETATM  138  H   UNL     1     -19.894  -0.304   1.946  1.00  0.00           H  
HETATM  139  H   UNL     1     -21.573   1.264   1.011  1.00  0.00           H  
HETATM  140  H   UNL     1     -21.466   0.440  -0.563  1.00  0.00           H  
HETATM  141  H   UNL     1     -23.414  -0.373   0.737  1.00  0.00           H  
HETATM  142  H   UNL     1     -22.223  -1.672   0.491  1.00  0.00           H  
HETATM  143  H   UNL     1     -22.330  -0.848   2.065  1.00  0.00           H  
HETATM  144  H   UNL     1      -2.748  -8.342   1.206  1.00  0.00           H  
HETATM  145  H   UNL     1      -4.376  -8.342   0.488  1.00  0.00           H  
HETATM  146  H   UNL     1      -3.545  -9.725  -1.396  1.00  0.00           H  
HETATM  147  H   UNL     1      -1.917  -9.725  -0.677  1.00  0.00           H  
HETATM  148  H   UNL     1      -2.812 -10.835   1.351  1.00  0.00           H  
HETATM  149  H   UNL     1      -4.440 -10.835   0.632  1.00  0.00           H  
HETATM  150  H   UNL     1      -3.609 -12.218  -1.251  1.00  0.00           H  
HETATM  151  H   UNL     1      -1.981 -12.218  -0.532  1.00  0.00           H  
HETATM  152  H   UNL     1      -2.876 -13.329   1.496  1.00  0.00           H  
HETATM  153  H   UNL     1      -4.504 -13.329   0.777  1.00  0.00           H  
HETATM  154  H   UNL     1      -3.389 -15.520   0.454  1.00  0.00           H  
HETATM  155  H   UNL     1      -3.673 -14.712  -1.106  1.00  0.00           H  
HETATM  156  H   UNL     1      -2.045 -14.712  -0.387  1.00  0.00           H  
CONECT    1   60    3    3    4                                       
CONECT    2    4   35   36                                            
CONECT    3    1    1                                                 
CONECT    4    2    1   71   72                                       
CONECT    5    6   64   73   74                                       
CONECT    6    5   24   75   76                                       
CONECT    7    8   20   77   78                                       
CONECT    8    7   61   79   80                                       
CONECT    9   50   50                                                 
CONECT   10   51   81                                                 
CONECT   11   52   52                                                 
CONECT   12   53   53                                                 
CONECT   13   54   54                                                 
CONECT   14   55   55                                                 
CONECT   15   59   59                                                 
CONECT   16   50   82                                                 
CONECT   17   51   51                                                 
CONECT   18   52   83                                                 
CONECT   19   59   70                                                 
CONECT   20    7   21   84   85                                       
CONECT   21   20   22   86   87                                       
CONECT   22   21   23   88   89                                       
CONECT   23   22   25   90   91                                       
CONECT   24    6   26   92   93                                       
CONECT   25   27   23   94   95                                       
CONECT   26   24   28   96   97                                       
CONECT   27   25   29   98   99                                       
CONECT   28   26   30  100  101                                       
CONECT   29   27   33  102  103                                       
CONECT   30   28   34  104  105                                       
CONECT   31   45   32  106  107                                       
CONECT   32   31   47  108  109                                       
CONECT   33   29   54  110  111                                       
CONECT   34   30   55  112  113                                       
CONECT   35   37    2  114  115                                       
CONECT   36    2   38  116  117                                       
CONECT   37   35   57  118  119                                       
CONECT   38   36   58  120  121                                       
CONECT   39   56   46  122  123                                       
CONECT   40   48   56  124  125                                       
CONECT   41   50   57  126  127                                       
CONECT   42   57   51  128  129                                       
CONECT   43   52   58  130  131                                       
CONECT   44   58   53  132  133                                       
CONECT   45   31   53  134                                            
CONECT   46   39   54                                                 
CONECT   47   32   59                                                 
CONECT   48   40   59                                                 
CONECT   49   56   55                                                 
CONECT   50   41   16    9    9                                       
CONECT   51   17   17   42   10                                       
CONECT   52   43   11   11   18                                       
CONECT   53   12   12   45   44                                       
CONECT   54   33   46   13   13                                       
CONECT   55   34   49   14   14                                       
CONECT   56   39   49   40  135                                       
CONECT   57   37   42   41                                            
CONECT   58   38   44   43                                            
CONECT   59   19   48   15   15                                       
CONECT   59   47                                                      
CONECT   60    1  136                                                 
CONECT   61    8   62  137  138                                       
CONECT   62   61   63  139  140                                       
CONECT   63   62  141  142  143                                       
CONECT   64    5   65  144  145                                       
CONECT   65   64   66  146  147                                       
CONECT   66   65   67  148  149                                       
CONECT   67   66   68  150  151                                       
CONECT   68   67   69  152  153                                       
CONECT   69   68  154  155  156                                       
CONECT   70   19                                                      
CONECT   71    4                                                      
CONECT   72    4                                                      
CONECT   73    5                                                      
CONECT   74    5                                                      
CONECT   75    6                                                      
CONECT   76    6                                                      
CONECT   77    7                                                      
CONECT   78    7                                                      
CONECT   79    8                                                      
CONECT   80    8                                                      
CONECT   81   10                                                      
CONECT   82   16                                                      
CONECT   83   18                                                      
CONECT   84   20                                                      
CONECT   85   20                                                      
CONECT   86   21                                                      
CONECT   87   21                                                      
CONECT   88   22                                                      
CONECT   89   22                                                      
CONECT   90   23                                                      
CONECT   91   23                                                      
CONECT   92   24                                                      
CONECT   93   24                                                      
CONECT   94   25                                                      
CONECT   95   25                                                      
CONECT   96   26                                                      
CONECT   97   26                                                      
CONECT   98   27                                                      
CONECT   99   27                                                      
CONECT  100   28                                                      
CONECT  101   28                                                      
CONECT  102   29                                                      
CONECT  103   29                                                      
CONECT  104   30                                                      
CONECT  105   30                                                      
CONECT  106   31                                                      
CONECT  107   31                                                      
CONECT  108   32                                                      
CONECT  109   32                                                      
CONECT  110   33                                                      
CONECT  111   33                                                      
CONECT  112   34                                                      
CONECT  113   34                                                      
CONECT  114   35                                                      
CONECT  115   35                                                      
CONECT  116   36                                                      
CONECT  117   36                                                      
CONECT  118   37                                                      
CONECT  119   37                                                      
CONECT  120   38                                                      
CONECT  121   38                                                      
CONECT  122   39                                                      
CONECT  123   39                                                      
CONECT  124   40                                                      
CONECT  125   40                                                      
CONECT  126   41                                                      
CONECT  127   41                                                      
CONECT  128   42                                                      
CONECT  129   42                                                      
CONECT  130   43                                                      
CONECT  131   43                                                      
CONECT  132   44                                                      
CONECT  133   44                                                      
CONECT  134   45                                                      
CONECT  135   56                                                      
CONECT  136   60                                                      
CONECT  137   61                                                      
CONECT  138   61                                                      
CONECT  139   62                                                      
CONECT  140   62                                                      
CONECT  141   63                                                      
CONECT  142   63                                                      
CONECT  143   63                                                      
CONECT  144   64                                                      
CONECT  145   64                                                      
CONECT  146   65                                                      
CONECT  147   65                                                      
CONECT  148   66                                                      
CONECT  149   66                                                      
CONECT  150   67                                                      
CONECT  151   67                                                      
CONECT  152   68                                                      
CONECT  153   68                                                      
CONECT  154   69                                                      
CONECT  155   69                                                      
CONECT  156   69                                                      
MASTER        0    0    0    0    0    0    0    0  156    0  156    0
END
