COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.851   2.543   2.882  1.00  0.00           C  
HETATM    2  C   UNL     1       8.168   2.456   1.515  1.00  0.00           C  
HETATM    3  O   UNL     1       6.980   1.628   1.619  1.00  0.00           O  
HETATM    4  C   UNL     1       6.258   1.449   0.495  1.00  0.00           C  
HETATM    5  O   UNL     1       6.612   1.972  -0.544  1.00  0.00           O  
HETATM    6  C   UNL     1       5.044   0.622   0.525  1.00  0.00           C  
HETATM    7  C   UNL     1       4.331   0.446  -0.585  1.00  0.00           C  
HETATM    8  C   UNL     1       3.085  -0.402  -0.553  1.00  0.00           C  
HETATM    9  C   UNL     1       3.243  -1.575  -1.523  1.00  0.00           C  
HETATM   10  C   UNL     1       4.359  -2.498  -1.029  1.00  0.00           C  
HETATM   11  C   UNL     1       4.649  -3.602  -2.073  1.00  0.00           C  
HETATM   12  C   UNL     1       4.957  -4.816  -1.169  1.00  0.00           C  
HETATM   13  N   UNL     1       4.256  -4.554   0.093  1.00  0.00           N  
HETATM   14  C   UNL     1       3.913  -3.258   0.200  1.00  0.00           C  
HETATM   15  O   UNL     1       3.331  -2.770   1.146  1.00  0.00           O  
HETATM   16  N   UNL     1       1.932   0.409  -0.952  1.00  0.00           N  
HETATM   17  C   UNL     1       0.703   0.104  -0.492  1.00  0.00           C  
HETATM   18  O   UNL     1       0.535  -0.895   0.175  1.00  0.00           O  
HETATM   19  C   UNL     1      -0.464   1.004  -0.808  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.197   2.402  -0.247  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.322   3.347  -0.673  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.121   4.711  -0.011  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.301   3.510  -2.194  1.00  0.00           C  
HETATM   24  N   UNL     1      -1.680   0.458  -0.199  1.00  0.00           N  
HETATM   25  C   UNL     1      -2.887   0.757  -0.720  1.00  0.00           C  
HETATM   26  O   UNL     1      -2.967   1.480  -1.695  1.00  0.00           O  
HETATM   27  C   UNL     1      -4.106   0.210  -0.110  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.375   0.438  -0.541  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.254  -0.267   0.312  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.653  -0.405   0.356  1.00  0.00           C  
HETATM   31  O   UNL     1      -8.430   0.224  -0.563  1.00  0.00           O  
HETATM   32  C   UNL     1      -9.842   0.036  -0.455  1.00  0.00           C  
HETATM   33  C   UNL     1      -8.231  -1.184   1.338  1.00  0.00           C  
HETATM   34  C   UNL     1      -7.440  -1.829   2.279  1.00  0.00           C  
HETATM   35  C   UNL     1      -6.069  -1.704   2.250  1.00  0.00           C  
HETATM   36  C   UNL     1      -5.460  -0.925   1.271  1.00  0.00           C  
HETATM   37  N   UNL     1      -4.147  -0.625   0.992  1.00  0.00           N  
HETATM   38  H   UNL     1       9.133   1.542   3.210  1.00  0.00           H  
HETATM   39  H   UNL     1       9.742   3.165   2.803  1.00  0.00           H  
HETATM   40  H   UNL     1       8.163   2.982   3.604  1.00  0.00           H  
HETATM   41  H   UNL     1       7.885   3.457   1.186  1.00  0.00           H  
HETATM   42  H   UNL     1       8.855   2.017   0.793  1.00  0.00           H  
HETATM   43  H   UNL     1       4.729   0.158   1.449  1.00  0.00           H  
HETATM   44  H   UNL     1       4.645   0.910  -1.508  1.00  0.00           H  
HETATM   45  H   UNL     1       2.930  -0.783   0.456  1.00  0.00           H  
HETATM   46  H   UNL     1       2.307  -2.132  -1.574  1.00  0.00           H  
HETATM   47  H   UNL     1       3.495  -1.197  -2.513  1.00  0.00           H  
HETATM   48  H   UNL     1       5.262  -1.925  -0.819  1.00  0.00           H  
HETATM   49  H   UNL     1       3.774  -3.791  -2.695  1.00  0.00           H  
HETATM   50  H   UNL     1       5.512  -3.342  -2.685  1.00  0.00           H  
HETATM   51  H   UNL     1       4.582  -5.732  -1.626  1.00  0.00           H  
HETATM   52  H   UNL     1       6.031  -4.895  -0.996  1.00  0.00           H  
HETATM   53  H   UNL     1       4.064  -5.228   0.763  1.00  0.00           H  
HETATM   54  H   UNL     1       2.054   1.166  -1.546  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.595   1.065  -1.888  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.155   2.355   0.841  1.00  0.00           H  
HETATM   57  H   UNL     1       0.754   2.772  -0.631  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.282   2.931  -0.365  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.161   5.127  -0.319  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.923   5.384  -0.315  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.135   4.595   1.073  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.445   2.538  -2.666  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.103   4.183  -2.498  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.342   3.926  -2.502  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.617  -0.119   0.578  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.660   1.048  -1.385  1.00  0.00           H  
HETATM   67  H   UNL     1     -10.344   0.592  -1.247  1.00  0.00           H  
HETATM   68  H   UNL     1     -10.077  -1.024  -0.549  1.00  0.00           H  
HETATM   69  H   UNL     1     -10.184   0.398   0.515  1.00  0.00           H  
HETATM   70  H   UNL     1      -9.305  -1.293   1.374  1.00  0.00           H  
HETATM   71  H   UNL     1      -7.906  -2.435   3.042  1.00  0.00           H  
HETATM   72  H   UNL     1      -5.466  -2.212   2.989  1.00  0.00           H  
HETATM   73  H   UNL     1      -3.377  -0.944   1.488  1.00  0.00           H  
CONECT    1    2   38   39   40                                       
CONECT    2    3    1   41   42                                       
CONECT    3    4    2                                                 
CONECT    4    6    5    5    3                                       
CONECT    5    4    4                                                 
CONECT    6    7    7    4   43                                       
CONECT    7    8    6    6   44                                       
CONECT    8    9   16    7   45                                       
CONECT    9   10    8   46   47                                       
CONECT   10   14    9   11   48                                       
CONECT   11   10   12   49   50                                       
CONECT   12   13   11   51   52                                       
CONECT   13   14   12   53                                            
CONECT   14   15   15   13   10                                       
CONECT   15   14   14                                                 
CONECT   16    8   17   54                                            
CONECT   17   16   19   18   18                                       
CONECT   18   17   17                                                 
CONECT   19   24   17   20   55                                       
CONECT   20   19   21   56   57                                       
CONECT   21   22   20   23   58                                       
CONECT   22   21   59   60   61                                       
CONECT   23   21   62   63   64                                       
CONECT   24   25   19   65                                            
CONECT   25   26   26   27   24                                       
CONECT   26   25   25                                                 
CONECT   27   37   25   28   28                                       
CONECT   28   27   27   29   66                                       
CONECT   29   36   36   30   28                                       
CONECT   30   33   33   29   31                                       
CONECT   31   30   32                                                 
CONECT   32   31   67   68   69                                       
CONECT   33   34   30   30   70                                       
CONECT   34   35   35   33   71                                       
CONECT   35   34   34   36   72                                       
CONECT   36   35   37   29   29                                       
CONECT   37   36   27   73                                            
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    2                                                      
CONECT   42    2                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47    9                                                      
CONECT   48   10                                                      
CONECT   49   11                                                      
CONECT   50   11                                                      
CONECT   51   12                                                      
CONECT   52   12                                                      
CONECT   53   13                                                      
CONECT   54   16                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   22                                                      
CONECT   62   23                                                      
CONECT   63   23                                                      
CONECT   64   23                                                      
CONECT   65   24                                                      
CONECT   66   28                                                      
CONECT   67   32                                                      
CONECT   68   32                                                      
CONECT   69   32                                                      
CONECT   70   33                                                      
CONECT   71   34                                                      
CONECT   72   35                                                      
CONECT   73   37                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
