COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.597   3.707   0.561  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.174   2.348  -0.002  1.00  0.00           C  
HETATM    3  N   UNL     1      -1.783   2.418  -0.455  1.00  0.00           N  
HETATM    4  C   UNL     1      -4.077   1.981  -1.181  1.00  0.00           C  
HETATM    5  O   UNL     1      -5.442   1.997  -0.759  1.00  0.00           O  
HETATM    6  C   UNL     1      -3.721   0.603  -1.677  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.645  -0.322  -1.761  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.288  -1.700  -2.257  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.718  -2.741  -1.221  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.356  -4.140  -1.724  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.786  -5.181  -0.689  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.424  -6.580  -1.192  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.853  -7.621  -0.157  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.492  -9.020  -0.660  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.921 -10.061   0.375  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.559 -11.460  -0.128  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.989 -12.502   0.908  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.627 -13.901   0.405  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.057 -14.942   1.440  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.695 -16.341   0.937  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.983   5.987  -0.069  1.00  0.00           C  
HETATM   22  O   UNL     1      -3.600   4.676  -0.489  1.00  0.00           O  
HETATM   23  C   UNL     1      -3.833   6.963  -1.239  1.00  0.00           C  
HETATM   24  O   UNL     1      -2.461   7.025  -1.636  1.00  0.00           O  
HETATM   25  C   UNL     1      -4.301   8.353  -0.797  1.00  0.00           C  
HETATM   26  O   UNL     1      -4.231   9.255  -1.904  1.00  0.00           O  
HETATM   27  C   UNL     1      -5.747   8.259  -0.301  1.00  0.00           C  
HETATM   28  O   UNL     1      -6.171   9.536   0.181  1.00  0.00           O  
HETATM   29  O   UNL     1      -7.331   6.221   2.427  1.00  0.00           O  
HETATM   30  C   UNL     1      -5.824   7.233   0.833  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.275   7.089   1.294  1.00  0.00           C  
HETATM   32  O   UNL     1      -5.345   5.971   0.364  1.00  0.00           O  
HETATM   33  C   UNL     1      -0.778   2.223   0.422  1.00  0.00           C  
HETATM   34  O   UNL     1      -1.026   1.989   1.586  1.00  0.00           O  
HETATM   35  C   UNL     1       0.653   2.295  -0.044  1.00  0.00           C  
HETATM   36  C   UNL     1       1.589   2.038   1.139  1.00  0.00           C  
HETATM   37  C   UNL     1       3.042   2.112   0.666  1.00  0.00           C  
HETATM   38  C   UNL     1       3.977   1.855   1.849  1.00  0.00           C  
HETATM   39  C   UNL     1       5.430   1.928   1.376  1.00  0.00           C  
HETATM   40  C   UNL     1       6.365   1.671   2.559  1.00  0.00           C  
HETATM   41  C   UNL     1       7.819   1.745   2.086  1.00  0.00           C  
HETATM   42  C   UNL     1       8.740   1.492   3.251  1.00  0.00           C  
HETATM   43  C   UNL     1       9.674   0.578   3.161  1.00  0.00           C  
HETATM   44  C   UNL     1       9.929  -0.113   1.846  1.00  0.00           C  
HETATM   45  C   UNL     1      11.411   0.004   1.487  1.00  0.00           C  
HETATM   46  C   UNL     1      11.670  -0.697   0.152  1.00  0.00           C  
HETATM   47  C   UNL     1      13.152  -0.581  -0.207  1.00  0.00           C  
HETATM   48  C   UNL     1      13.410  -1.282  -1.542  1.00  0.00           C  
HETATM   49  C   UNL     1      14.893  -1.165  -1.901  1.00  0.00           C  
HETATM   50  C   UNL     1      15.151  -1.866  -3.236  1.00  0.00           C  
HETATM   51  C   UNL     1      16.634  -1.749  -3.595  1.00  0.00           C  
HETATM   52  H   UNL     1      -6.143  10.236  -0.485  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.266   1.589   0.776  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.343   9.357  -2.272  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.096   6.177  -1.923  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.937   2.704  -1.985  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.704   0.378  -1.962  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.937  -6.771  -2.134  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.347  -6.643  -1.346  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.597   3.629   0.987  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.340  -7.430   0.785  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.895   4.014   1.336  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.931  -7.558  -0.003  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.344   6.306   0.755  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.005  -9.211  -1.602  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.414  -9.084  -0.814  1.00  0.00           H  
HETATM   67  H   UNL     1      16.818  -2.249  -4.546  1.00  0.00           H  
HETATM   68  H   UNL     1      -4.440   6.622  -2.077  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.407  -9.870   1.318  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.998  -9.998   0.529  1.00  0.00           H  
HETATM   71  H   UNL     1      -3.662   8.715   0.008  1.00  0.00           H  
HETATM   72  H   UNL     1      -5.073 -11.652  -1.070  1.00  0.00           H  
HETATM   73  H   UNL     1      -3.482 -11.524  -0.282  1.00  0.00           H  
HETATM   74  H   UNL     1      -6.394   7.946  -1.121  1.00  0.00           H  
HETATM   75  H   UNL     1      -4.475 -12.311   1.850  1.00  0.00           H  
HETATM   76  H   UNL     1      -5.661  -0.097  -1.475  1.00  0.00           H  
HETATM   77  H   UNL     1      -6.066 -12.438   1.062  1.00  0.00           H  
HETATM   78  H   UNL     1      -8.224   6.083   2.774  1.00  0.00           H  
HETATM   79  H   UNL     1      -5.208   7.568   1.668  1.00  0.00           H  
HETATM   80  H   UNL     1      -4.802  -1.891  -3.199  1.00  0.00           H  
HETATM   81  H   UNL     1      -5.141 -14.092  -0.538  1.00  0.00           H  
HETATM   82  H   UNL     1      -3.211  -1.763  -2.411  1.00  0.00           H  
HETATM   83  H   UNL     1      -3.550 -13.964   0.251  1.00  0.00           H  
HETATM   84  H   UNL     1      -4.204  -2.550  -0.279  1.00  0.00           H  
HETATM   85  H   UNL     1      -4.543 -14.751   2.382  1.00  0.00           H  
HETATM   86  H   UNL     1      -5.795  -2.677  -1.067  1.00  0.00           H  
HETATM   87  H   UNL     1      -6.134 -14.878   1.594  1.00  0.00           H  
HETATM   88  H   UNL     1      -4.870  -4.331  -2.667  1.00  0.00           H  
HETATM   89  H   UNL     1      -5.001 -17.083   1.674  1.00  0.00           H  
HETATM   90  H   UNL     1      -3.279  -4.203  -1.878  1.00  0.00           H  
HETATM   91  H   UNL     1      -5.208 -16.532  -0.005  1.00  0.00           H  
HETATM   92  H   UNL     1      -3.618 -16.404   0.783  1.00  0.00           H  
HETATM   93  H   UNL     1      -4.272  -4.990   0.253  1.00  0.00           H  
HETATM   94  H   UNL     1      -5.863  -5.118  -0.535  1.00  0.00           H  
HETATM   95  H   UNL     1      -7.874   6.670   0.485  1.00  0.00           H  
HETATM   96  H   UNL     1      -7.669   8.068   1.566  1.00  0.00           H  
HETATM   97  H   UNL     1       0.824   1.541  -0.812  1.00  0.00           H  
HETATM   98  H   UNL     1       0.852   3.284  -0.456  1.00  0.00           H  
HETATM   99  H   UNL     1       1.418   2.793   1.907  1.00  0.00           H  
HETATM  100  H   UNL     1       1.390   1.049   1.551  1.00  0.00           H  
HETATM  101  H   UNL     1       3.212   1.357  -0.102  1.00  0.00           H  
HETATM  102  H   UNL     1       3.240   3.101   0.254  1.00  0.00           H  
HETATM  103  H   UNL     1       3.807   2.609   2.617  1.00  0.00           H  
HETATM  104  H   UNL     1       3.779   0.865   2.261  1.00  0.00           H  
HETATM  105  H   UNL     1       5.601   1.174   0.608  1.00  0.00           H  
HETATM  106  H   UNL     1       5.629   2.918   0.964  1.00  0.00           H  
HETATM  107  H   UNL     1       6.195   2.426   3.327  1.00  0.00           H  
HETATM  108  H   UNL     1       6.167   0.682   2.971  1.00  0.00           H  
HETATM  109  H   UNL     1       7.989   0.990   1.317  1.00  0.00           H  
HETATM  110  H   UNL     1       8.017   2.734   1.673  1.00  0.00           H  
HETATM  111  H   UNL     1       8.630   2.064   4.160  1.00  0.00           H  
HETATM  112  H   UNL     1      10.262   0.319   4.030  1.00  0.00           H  
HETATM  113  H   UNL     1       9.657  -1.165   1.930  1.00  0.00           H  
HETATM  114  H   UNL     1       9.328   0.356   1.067  1.00  0.00           H  
HETATM  115  H   UNL     1      11.683   1.056   1.403  1.00  0.00           H  
HETATM  116  H   UNL     1      12.012  -0.465   2.266  1.00  0.00           H  
HETATM  117  H   UNL     1      11.398  -1.750   0.236  1.00  0.00           H  
HETATM  118  H   UNL     1      11.069  -0.228  -0.627  1.00  0.00           H  
HETATM  119  H   UNL     1      13.424   0.472  -0.291  1.00  0.00           H  
HETATM  120  H   UNL     1      -1.585   2.605  -1.386  1.00  0.00           H  
HETATM  121  H   UNL     1      13.753  -1.050   0.572  1.00  0.00           H  
HETATM  122  H   UNL     1      13.139  -2.334  -1.458  1.00  0.00           H  
HETATM  123  H   UNL     1      12.810  -0.812  -2.321  1.00  0.00           H  
HETATM  124  H   UNL     1      -5.623   1.437   0.008  1.00  0.00           H  
HETATM  125  H   UNL     1      15.165  -0.113  -1.985  1.00  0.00           H  
HETATM  126  H   UNL     1      15.494  -1.634  -1.122  1.00  0.00           H  
HETATM  127  H   UNL     1      14.880  -2.919  -3.152  1.00  0.00           H  
HETATM  128  H   UNL     1      14.551  -1.397  -4.015  1.00  0.00           H  
HETATM  129  H   UNL     1      16.906  -0.697  -3.679  1.00  0.00           H  
HETATM  130  H   UNL     1      17.235  -2.219  -2.816  1.00  0.00           H  
CONECT    1   62    2   60   22                                       
CONECT    2    1    4   53    3                                       
CONECT    3    2   33  120                                            
CONECT    4    2    5    6   56                                       
CONECT    5    4  124                                                 
CONECT    6    4   57    7    7                                       
CONECT    7    6    6    8   76                                       
CONECT    8    7   82    9   80                                       
CONECT    9    8   84   10   86                                       
CONECT   10    9   90   11   88                                       
CONECT   11   10   93   12   94                                       
CONECT   12   11   58   13   59                                       
CONECT   13   12   63   14   61                                       
CONECT   14   13   66   65   15                                       
CONECT   15   14   16   69   70                                       
CONECT   16   15   72   73   17                                       
CONECT   17   16   18   77   75                                       
CONECT   18   17   81   83   19                                       
CONECT   19   18   85   20   87                                       
CONECT   20   19   91   92   89                                       
CONECT   21   22   32   64   23                                       
CONECT   22    1   21                                                 
CONECT   23   21   68   24   25                                       
CONECT   24   23   55                                                 
CONECT   25   23   27   71   26                                       
CONECT   26   25   54                                                 
CONECT   27   25   30   74   28                                       
CONECT   28   27   52                                                 
CONECT   29   78   31                                                 
CONECT   30   27   32   31   79                                       
CONECT   31   29   30   95   96                                       
CONECT   32   21   30                                                 
CONECT   33    3   34   34   35                                       
CONECT   34   33   33                                                 
CONECT   35   33   36   97   98                                       
CONECT   36   35  100   99   37                                       
CONECT   37   36   38  101  102                                       
CONECT   38   37  104  103   39                                       
CONECT   39   38   40  105  106                                       
CONECT   40   39  107  108   41                                       
CONECT   41   40   42  110  109                                       
CONECT   42   41  111   43   43                                       
CONECT   43   42   42  112   44                                       
CONECT   44   43  113  114   45                                       
CONECT   45   44  115  116   46                                       
CONECT   46   45  118  117   47                                       
CONECT   47   46  119  121   48                                       
CONECT   48   47  123  122   49                                       
CONECT   49   48  125  126   50                                       
CONECT   50   49  128  127   51                                       
CONECT   51   50  130   67  129                                       
CONECT   52   28                                                      
CONECT   53    2                                                      
CONECT   54   26                                                      
CONECT   55   24                                                      
CONECT   56    4                                                      
CONECT   57    6                                                      
CONECT   58   12                                                      
CONECT   59   12                                                      
CONECT   60    1                                                      
CONECT   61   13                                                      
CONECT   62    1                                                      
CONECT   63   13                                                      
CONECT   64   21                                                      
CONECT   65   14                                                      
CONECT   66   14                                                      
CONECT   67   51                                                      
CONECT   68   23                                                      
CONECT   69   15                                                      
CONECT   70   15                                                      
CONECT   71   25                                                      
CONECT   72   16                                                      
CONECT   73   16                                                      
CONECT   74   27                                                      
CONECT   75   17                                                      
CONECT   76    7                                                      
CONECT   77   17                                                      
CONECT   78   29                                                      
CONECT   79   30                                                      
CONECT   80    8                                                      
CONECT   81   18                                                      
CONECT   82    8                                                      
CONECT   83   18                                                      
CONECT   84    9                                                      
CONECT   85   19                                                      
CONECT   86    9                                                      
CONECT   87   19                                                      
CONECT   88   10                                                      
CONECT   89   20                                                      
CONECT   90   10                                                      
CONECT   91   20                                                      
CONECT   92   20                                                      
CONECT   93   11                                                      
CONECT   94   11                                                      
CONECT   95   31                                                      
CONECT   96   31                                                      
CONECT   97   35                                                      
CONECT   98   35                                                      
CONECT   99   36                                                      
CONECT  100   36                                                      
CONECT  101   37                                                      
CONECT  102   37                                                      
CONECT  103   38                                                      
CONECT  104   38                                                      
CONECT  105   39                                                      
CONECT  106   39                                                      
CONECT  107   40                                                      
CONECT  108   40                                                      
CONECT  109   41                                                      
CONECT  110   41                                                      
CONECT  111   42                                                      
CONECT  112   43                                                      
CONECT  113   44                                                      
CONECT  114   44                                                      
CONECT  115   45                                                      
CONECT  116   45                                                      
CONECT  117   46                                                      
CONECT  118   46                                                      
CONECT  119   47                                                      
CONECT  120    3                                                      
CONECT  121   47                                                      
CONECT  122   48                                                      
CONECT  123   48                                                      
CONECT  124    5                                                      
CONECT  125   49                                                      
CONECT  126   49                                                      
CONECT  127   50                                                      
CONECT  128   50                                                      
CONECT  129   51                                                      
CONECT  130   51                                                      
MASTER        0    0    0    0    0    0    0    0  130    0  130    0
END
