COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.719   0.219  -2.656  1.00  0.00           C  
HETATM    2  C   UNL     1       0.225  -0.852  -3.629  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.057  -0.214  -4.991  1.00  0.00           C  
HETATM    4  C   UNL     1       1.225   0.415  -5.535  1.00  0.00           C  
HETATM    5  C   UNL     1       1.719   1.488  -4.562  1.00  0.00           C  
HETATM    6  C   UNL     1       2.002   0.850  -3.200  1.00  0.00           C  
HETATM    7  O   UNL     1       0.983  -0.376  -1.384  1.00  0.00           O  
HETATM    8  O   UNL     1       1.226  -1.861  -3.775  1.00  0.00           O  
HETATM    9  O   UNL     1      -0.518  -1.216  -5.900  1.00  0.00           O  
HETATM   10  O   UNL     1       0.961   1.011  -6.807  1.00  0.00           O  
HETATM   11  O   UNL     1       2.918   2.077  -5.070  1.00  0.00           O  
HETATM   12  O   UNL     1       2.463   1.851  -2.291  1.00  0.00           O  
HETATM   13  P   UNL     1       0.024   0.356  -0.319  1.00  0.00           P  
HETATM   14  O   UNL     1      -1.513   0.139  -0.743  1.00  0.00           O  
HETATM   15  O   UNL     1       0.329   1.804  -0.294  1.00  0.00           O  
HETATM   16  O   UNL     1       0.270  -0.269   1.143  1.00  0.00           O  
HETATM   17  P   UNL     1      -1.990  -0.770  -6.375  1.00  0.00           P  
HETATM   18  O   UNL     1      -2.574  -1.860  -7.407  1.00  0.00           O  
HETATM   19  O   UNL     1      -1.915   0.548  -7.042  1.00  0.00           O  
HETATM   20  O   UNL     1      -2.961  -0.670  -5.095  1.00  0.00           O  
HETATM   21  C   UNL     1      -0.604   0.418   2.039  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.419  -0.131   3.455  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.356   0.604   4.415  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.904   0.582   6.772  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.722   0.041   8.167  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.659   0.777   9.126  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.473   0.228  10.542  1.00  0.00           C  
HETATM   28  C   UNL     1       1.526  -0.793   4.734  1.00  0.00           C  
HETATM   29  C   UNL     1       2.954  -0.588   5.170  1.00  0.00           C  
HETATM   30  C   UNL     1       3.355  -1.698   6.143  1.00  0.00           C  
HETATM   31  C   UNL     1       4.804  -1.490   6.586  1.00  0.00           C  
HETATM   32  O   UNL     1       0.956   0.066   3.875  1.00  0.00           O  
HETATM   33  O   UNL     1      -1.180   0.083   5.758  1.00  0.00           O  
HETATM   34  O   UNL     1      -2.701   1.466   6.567  1.00  0.00           O  
HETATM   35  O   UNL     1       0.894  -1.731   5.158  1.00  0.00           O  
HETATM   36  H   UNL     1      -0.045   0.988  -2.545  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.689  -1.302  -3.241  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.821   0.554  -4.880  1.00  0.00           H  
HETATM   39  H   UNL     1       1.989  -0.353  -5.646  1.00  0.00           H  
HETATM   40  H   UNL     1       0.955   2.257  -4.451  1.00  0.00           H  
HETATM   41  H   UNL     1       2.766   0.080  -3.311  1.00  0.00           H  
HETATM   42  H   UNL     1       0.876  -2.516  -4.394  1.00  0.00           H  
HETATM   43  H   UNL     1       1.793   1.396  -7.113  1.00  0.00           H  
HETATM   44  H   UNL     1       2.696   2.466  -5.927  1.00  0.00           H  
HETATM   45  H   UNL     1       3.271   2.222  -2.671  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.670  -0.815  -0.747  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.454  -1.556  -7.667  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.982  -1.548  -4.691  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.637   0.269   1.724  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.371   1.482   2.030  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.652  -1.196   3.465  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.389   0.456   4.099  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.123   1.669   4.405  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.689   0.190   8.482  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.955  -1.023   8.177  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.691   0.629   8.811  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.425   1.842   9.117  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.141   0.752  11.226  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.707  -0.836  10.552  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.441   0.376  10.857  1.00  0.00           H  
HETATM   61  H   UNL     1       3.607  -0.615   4.298  1.00  0.00           H  
HETATM   62  H   UNL     1       3.047   0.379   5.664  1.00  0.00           H  
HETATM   63  H   UNL     1       2.701  -1.671   7.015  1.00  0.00           H  
HETATM   64  H   UNL     1       3.261  -2.665   5.649  1.00  0.00           H  
HETATM   65  H   UNL     1       5.090  -2.281   7.279  1.00  0.00           H  
HETATM   66  H   UNL     1       5.458  -1.517   5.714  1.00  0.00           H  
HETATM   67  H   UNL     1       4.898  -0.523   7.080  1.00  0.00           H  
CONECT    1    2    6    7   36                                       
CONECT    2    1    3    8   37                                       
CONECT    3    2    4    9   38                                       
CONECT    4    3    5   10   39                                       
CONECT    5    4    6   11   40                                       
CONECT    6    1    5   12   41                                       
CONECT    7    1   13                                                 
CONECT    8    2   42                                                 
CONECT    9    3   17                                                 
CONECT   10    4   43                                                 
CONECT   11    5   44                                                 
CONECT   12    6   45                                                 
CONECT   13    7   14   15   15                                       
CONECT   13   16                                                      
CONECT   14   13   46                                                 
CONECT   15   13   13                                                 
CONECT   16   13   21                                                 
CONECT   17    9   18   19   19                                       
CONECT   17   20                                                      
CONECT   18   17   47                                                 
CONECT   19   17   17                                                 
CONECT   20   17   48                                                 
CONECT   21   16   22   49   50                                       
CONECT   22   21   23   32   51                                       
CONECT   23   22   33   52   53                                       
CONECT   24   25   33   34   34                                       
CONECT   25   24   26   54   55                                       
CONECT   26   25   27   56   57                                       
CONECT   27   26   58   59   60                                       
CONECT   28   29   32   35   35                                       
CONECT   29   28   30   61   62                                       
CONECT   30   29   31   63   64                                       
CONECT   31   30   65   66   67                                       
CONECT   32   22   28                                                 
CONECT   33   23   24                                                 
CONECT   34   24   24                                                 
CONECT   35   28   28                                                 
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    8                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   14                                                      
CONECT   47   18                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   21                                                      
CONECT   51   22                                                      
CONECT   52   23                                                      
CONECT   53   23                                                      
CONECT   54   25                                                      
CONECT   55   25                                                      
CONECT   56   26                                                      
CONECT   57   26                                                      
CONECT   58   27                                                      
CONECT   59   27                                                      
CONECT   60   27                                                      
CONECT   61   29                                                      
CONECT   62   29                                                      
CONECT   63   30                                                      
CONECT   64   30                                                      
CONECT   65   31                                                      
CONECT   66   31                                                      
CONECT   67   31                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
