COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.713   0.367  -4.382  1.00  0.00           C  
HETATM    2  C   UNL     1       0.165  -0.790  -3.551  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.980  -1.462  -4.314  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.090  -0.443  -4.582  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.534   0.713  -5.413  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.393   1.389  -4.649  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.334  -0.327  -2.194  1.00  0.00           C  
HETATM    8  C   UNL     1       1.272  -1.820  -3.319  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.532  -1.540  -1.285  1.00  0.00           C  
HETATM   10  C   UNL     1       0.531   0.726  -1.558  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.858  -1.135   0.160  1.00  0.00           C  
HETATM   12  C   UNL     1       0.217   1.070  -0.130  1.00  0.00           C  
HETATM   13  C   UNL     1       0.276  -0.266   0.662  1.00  0.00           C  
HETATM   14  C   UNL     1       1.614  -0.940   0.350  1.00  0.00           C  
HETATM   15  C   UNL     1       0.264   0.191   2.112  1.00  0.00           C  
HETATM   16  O   UNL     1      -1.078   1.664  -0.028  1.00  0.00           O  
HETATM   17  C   UNL     1       1.257   1.909   0.615  1.00  0.00           C  
HETATM   18  C   UNL     1       1.046  -0.790   2.987  1.00  0.00           C  
HETATM   19  C   UNL     1       0.961   1.577   2.105  1.00  0.00           C  
HETATM   20  C   UNL     1       1.007  -0.321   4.442  1.00  0.00           C  
HETATM   21  O   UNL     1       2.403  -0.849   2.541  1.00  0.00           O  
HETATM   22  C   UNL     1       0.414  -2.180   2.882  1.00  0.00           C  
HETATM   23  C   UNL     1       1.820   1.026  -3.586  1.00  0.00           C  
HETATM   24  C   UNL     1       1.519   1.351  -2.187  1.00  0.00           C  
HETATM   25  O   UNL     1      -1.042   0.212  -6.658  1.00  0.00           O  
HETATM   26  O   UNL     1      -3.153  -1.075  -5.298  1.00  0.00           O  
HETATM   27  O   UNL     1       1.778  -1.212   5.251  1.00  0.00           O  
HETATM   28  C   UNL     1      -0.440  -0.308   4.935  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.488   0.236   6.364  1.00  0.00           C  
HETATM   30  C   UNL     1      -1.936   0.249   6.857  1.00  0.00           C  
HETATM   31  C   UNL     1      -1.984   0.794   8.286  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.778   1.141   5.943  1.00  0.00           C  
HETATM   33  O   UNL     1       2.901   1.273  -4.080  1.00  0.00           O  
HETATM   34  H   UNL     1       1.108  -0.006  -5.327  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.378  -2.286  -3.722  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.601  -1.844  -5.262  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.468  -0.061  -3.634  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.325   1.439  -5.601  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.768   1.775  -3.701  1.00  0.00           H  
HETATM   40  H   UNL     1       0.006   2.211  -5.244  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.314   0.123  -2.347  1.00  0.00           H  
HETATM   42  H   UNL     1       1.729  -2.084  -4.273  1.00  0.00           H  
HETATM   43  H   UNL     1       2.029  -1.397  -2.658  1.00  0.00           H  
HETATM   44  H   UNL     1       0.847  -2.713  -2.860  1.00  0.00           H  
HETATM   45  H   UNL     1       0.379  -2.137  -1.289  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.351  -2.145  -1.676  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.950  -2.025   0.783  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.787  -0.566   0.186  1.00  0.00           H  
HETATM   49  H   UNL     1       1.682  -1.133  -0.720  1.00  0.00           H  
HETATM   50  H   UNL     1       2.430  -0.285   0.654  1.00  0.00           H  
HETATM   51  H   UNL     1       1.681  -1.882   0.894  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.760   0.284   2.472  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.020   2.536  -0.443  1.00  0.00           H  
HETATM   54  H   UNL     1       1.110   2.971   0.419  1.00  0.00           H  
HETATM   55  H   UNL     1       2.267   1.601   0.344  1.00  0.00           H  
HETATM   56  H   UNL     1       0.299   2.331   2.531  1.00  0.00           H  
HETATM   57  H   UNL     1       1.891   1.532   2.670  1.00  0.00           H  
HETATM   58  H   UNL     1       1.423   0.684   4.511  1.00  0.00           H  
HETATM   59  H   UNL     1       2.763   0.044   2.623  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.619  -2.135   3.222  1.00  0.00           H  
HETATM   61  H   UNL     1       0.442  -2.515   1.845  1.00  0.00           H  
HETATM   62  H   UNL     1       0.971  -2.880   3.505  1.00  0.00           H  
HETATM   63  H   UNL     1       2.101   2.099  -1.669  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.791  -0.204  -7.106  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.831  -0.401  -5.445  1.00  0.00           H  
HETATM   66  H   UNL     1       1.377  -2.087   5.162  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.839  -1.322   4.920  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.040   0.327   4.284  1.00  0.00           H  
HETATM   69  H   UNL     1      -0.090   1.251   6.380  1.00  0.00           H  
HETATM   70  H   UNL     1       0.111  -0.398   7.015  1.00  0.00           H  
HETATM   71  H   UNL     1      -2.334  -0.765   6.842  1.00  0.00           H  
HETATM   72  H   UNL     1      -3.016   0.803   8.637  1.00  0.00           H  
HETATM   73  H   UNL     1      -1.384   0.158   8.937  1.00  0.00           H  
HETATM   74  H   UNL     1      -1.586   1.809   8.301  1.00  0.00           H  
HETATM   75  H   UNL     1      -2.380   2.156   5.958  1.00  0.00           H  
HETATM   76  H   UNL     1      -2.745   0.753   4.925  1.00  0.00           H  
HETATM   77  H   UNL     1      -3.810   1.151   6.294  1.00  0.00           H  
CONECT    1    2    6   23   34                                       
CONECT    2    1    3    7    8                                       
CONECT    3    2    4   35   36                                       
CONECT    4    3    5   26   37                                       
CONECT    5    4    6   25   38                                       
CONECT    6    1    5   39   40                                       
CONECT    7    2    9   10   41                                       
CONECT    8    2   42   43   44                                       
CONECT    9    7   11   45   46                                       
CONECT   10    7   12   24   24                                       
CONECT   11    9   13   47   48                                       
CONECT   12   10   13   16   17                                       
CONECT   13   11   12   14   15                                       
CONECT   14   13   49   50   51                                       
CONECT   15   13   18   19   52                                       
CONECT   16   12   53                                                 
CONECT   17   12   19   54   55                                       
CONECT   18   15   20   21   22                                       
CONECT   19   15   17   56   57                                       
CONECT   20   18   27   28   58                                       
CONECT   21   18   59                                                 
CONECT   22   18   60   61   62                                       
CONECT   23    1   24   33   33                                       
CONECT   24   10   10   23   63                                       
CONECT   25    5   64                                                 
CONECT   26    4   65                                                 
CONECT   27   20   66                                                 
CONECT   28   20   29   67   68                                       
CONECT   29   28   30   69   70                                       
CONECT   30   29   31   32   71                                       
CONECT   31   30   72   73   74                                       
CONECT   32   30   75   76   77                                       
CONECT   33   23   23                                                 
CONECT   34    1                                                      
CONECT   35    3                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44    8                                                      
CONECT   45    9                                                      
CONECT   46    9                                                      
CONECT   47   11                                                      
CONECT   48   11                                                      
CONECT   49   14                                                      
CONECT   50   14                                                      
CONECT   51   14                                                      
CONECT   52   15                                                      
CONECT   53   16                                                      
CONECT   54   17                                                      
CONECT   55   17                                                      
CONECT   56   19                                                      
CONECT   57   19                                                      
CONECT   58   20                                                      
CONECT   59   21                                                      
CONECT   60   22                                                      
CONECT   61   22                                                      
CONECT   62   22                                                      
CONECT   63   24                                                      
CONECT   64   25                                                      
CONECT   65   26                                                      
CONECT   66   27                                                      
CONECT   67   28                                                      
CONECT   68   28                                                      
CONECT   69   29                                                      
CONECT   70   29                                                      
CONECT   71   30                                                      
CONECT   72   31                                                      
CONECT   73   31                                                      
CONECT   74   31                                                      
CONECT   75   32                                                      
CONECT   76   32                                                      
CONECT   77   32                                                      
MASTER        0    0    0    0    0    0    0    0   77    0   77    0
END
