COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.310  -0.366   0.026  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.567   0.537   0.000  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.069   0.552   0.029  1.00  0.00           C  
HETATM    4  C   UNL     1       1.429   0.567   0.057  1.00  0.00           C  
HETATM    5  C   UNL     1       5.025  -0.616   0.191  1.00  0.00           C  
HETATM    6  C   UNL     1       6.314   0.206   0.142  1.00  0.00           C  
HETATM    7  C   UNL     1     -18.557   0.449  -0.169  1.00  0.00           C  
HETATM    8  C   UNL     1     -17.303  -0.425  -0.087  1.00  0.00           C  
HETATM    9  C   UNL     1     -16.059   0.463  -0.141  1.00  0.00           C  
HETATM   10  C   UNL     1     -14.805  -0.410  -0.059  1.00  0.00           C  
HETATM   11  C   UNL     1     -13.560   0.478  -0.113  1.00  0.00           C  
HETATM   12  C   UNL     1     -12.307  -0.395  -0.031  1.00  0.00           C  
HETATM   13  C   UNL     1     -11.062   0.493  -0.085  1.00  0.00           C  
HETATM   14  C   UNL     1      -9.808  -0.380  -0.002  1.00  0.00           C  
HETATM   15  C   UNL     1      -8.564   0.508  -0.056  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.065   0.523  -0.028  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.812  -0.351   0.054  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.314  -0.336   0.083  1.00  0.00           C  
HETATM   19  C   UNL     1       0.185  -0.321   0.111  1.00  0.00           C  
HETATM   20  C   UNL     1       2.664  -0.293   0.138  1.00  0.00           C  
HETATM   21  C   UNL     1       7.519  -0.737   0.103  1.00  0.00           C  
HETATM   22  C   UNL     1      12.651   0.206  -0.691  1.00  0.00           C  
HETATM   23  C   UNL     1      13.409   1.509  -0.956  1.00  0.00           C  
HETATM   24  N   UNL     1      13.389   2.342   0.255  1.00  0.00           N  
HETATM   25  O   UNL     1       2.559  -1.493   0.229  1.00  0.00           O  
HETATM   26  O   UNL     1       3.880   0.274   0.108  1.00  0.00           O  
HETATM   27  O   UNL     1       8.716   0.027  -0.059  1.00  0.00           O  
HETATM   28  O   UNL     1      10.197  -1.656  -1.220  1.00  0.00           O  
HETATM   29  O   UNL     1      10.525  -1.348   1.264  1.00  0.00           O  
HETATM   30  O   UNL     1      11.272   0.496  -0.455  1.00  0.00           O  
HETATM   31  O   UNL     1       6.395   1.034   1.304  1.00  0.00           O  
HETATM   32  P   UNL     1      10.178  -0.642  -0.141  1.00  0.00           P  
HETATM   33  H   UNL     1      -7.318  -0.924   0.962  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.297  -1.061  -0.813  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.560   1.096  -0.936  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.581   1.233   0.839  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.062   1.111  -0.907  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.082   1.248   0.867  1.00  0.00           H  
HETATM   39  H   UNL     1       1.437   1.126  -0.879  1.00  0.00           H  
HETATM   40  H   UNL     1       1.416   1.263   0.896  1.00  0.00           H  
HETATM   41  H   UNL     1       5.005  -1.311  -0.649  1.00  0.00           H  
HETATM   42  H   UNL     1       4.985  -1.174   1.126  1.00  0.00           H  
HETATM   43  H   UNL     1       6.313   0.831  -0.751  1.00  0.00           H  
HETATM   44  H   UNL     1     -18.549   1.008  -1.105  1.00  0.00           H  
HETATM   45  H   UNL     1     -19.444  -0.184  -0.131  1.00  0.00           H  
HETATM   46  H   UNL     1     -18.570   1.145   0.669  1.00  0.00           H  
HETATM   47  H   UNL     1     -17.311  -0.983   0.849  1.00  0.00           H  
HETATM   48  H   UNL     1     -17.290  -1.121  -0.926  1.00  0.00           H  
HETATM   49  H   UNL     1     -16.051   1.022  -1.077  1.00  0.00           H  
HETATM   50  H   UNL     1     -16.072   1.160   0.697  1.00  0.00           H  
HETATM   51  H   UNL     1     -14.812  -0.969   0.877  1.00  0.00           H  
HETATM   52  H   UNL     1     -14.791  -1.106  -0.898  1.00  0.00           H  
HETATM   53  H   UNL     1     -13.553   1.037  -1.049  1.00  0.00           H  
HETATM   54  H   UNL     1     -13.574   1.174   0.726  1.00  0.00           H  
HETATM   55  H   UNL     1     -12.314  -0.954   0.905  1.00  0.00           H  
HETATM   56  H   UNL     1     -12.293  -1.091  -0.869  1.00  0.00           H  
HETATM   57  H   UNL     1     -11.055   1.052  -1.020  1.00  0.00           H  
HETATM   58  H   UNL     1     -11.076   1.189   0.754  1.00  0.00           H  
HETATM   59  H   UNL     1      -9.816  -0.939   0.933  1.00  0.00           H  
HETATM   60  H   UNL     1      -9.795  -1.076  -0.841  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.577   1.204   0.782  1.00  0.00           H  
HETATM   62  H   UNL     1      -8.556   1.067  -0.992  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.058   1.081  -0.964  1.00  0.00           H  
HETATM   64  H   UNL     1      -6.079   1.219   0.811  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.798  -1.047  -0.785  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.819  -0.910   0.990  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.321  -0.895   1.018  1.00  0.00           H  
HETATM   68  H   UNL     1      -2.300  -1.032  -0.756  1.00  0.00           H  
HETATM   69  H   UNL     1       0.177  -0.880   1.047  1.00  0.00           H  
HETATM   70  H   UNL     1       0.198  -1.017  -0.728  1.00  0.00           H  
HETATM   71  H   UNL     1       7.570  -1.299   1.035  1.00  0.00           H  
HETATM   72  H   UNL     1       7.412  -1.428  -0.733  1.00  0.00           H  
HETATM   73  H   UNL     1      12.742  -0.449  -1.558  1.00  0.00           H  
HETATM   74  H   UNL     1      13.074  -0.288   0.184  1.00  0.00           H  
HETATM   75  H   UNL     1      14.441   1.282  -1.223  1.00  0.00           H  
HETATM   76  H   UNL     1      12.931   2.047  -1.775  1.00  0.00           H  
HETATM   77  H   UNL     1      13.767   1.841   1.044  1.00  0.00           H  
HETATM   78  H   UNL     1      13.882   3.208   0.105  1.00  0.00           H  
HETATM   79  H   UNL     1      10.530  -0.742   2.017  1.00  0.00           H  
HETATM   80  H   UNL     1       6.401   0.544   2.137  1.00  0.00           H  
CONECT    1   16   15   33   34                                       
CONECT    2   17   18   35   36                                       
CONECT    3   19   18   37   38                                       
CONECT    4   19   20   39   40                                       
CONECT    5    6   26   41   42                                       
CONECT    6   21   31    5   43                                       
CONECT    7    8   44   45   46                                       
CONECT    8    7    9   47   48                                       
CONECT    9    8   10   49   50                                       
CONECT   10    9   11   51   52                                       
CONECT   11   10   12   53   54                                       
CONECT   12   11   13   55   56                                       
CONECT   13   12   14   57   58                                       
CONECT   14   13   15   59   60                                       
CONECT   15    1   14   61   62                                       
CONECT   16   17    1   63   64                                       
CONECT   17   16    2   65   66                                       
CONECT   18    2    3   67   68                                       
CONECT   19    3    4   69   70                                       
CONECT   20    4   26   25   25                                       
CONECT   21   27    6   71   72                                       
CONECT   22   23   30   73   74                                       
CONECT   23   24   22   75   76                                       
CONECT   24   23   77   78                                            
CONECT   25   20   20                                                 
CONECT   26    5   20                                                 
CONECT   27   21   32                                                 
CONECT   28   32   32                                                 
CONECT   29   32   79                                                 
CONECT   30   32   22                                                 
CONECT   31    6   80                                                 
CONECT   32   27   30   28   28                                       
CONECT   32   29                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46    7                                                      
CONECT   47    8                                                      
CONECT   48    8                                                      
CONECT   49    9                                                      
CONECT   50    9                                                      
CONECT   51   10                                                      
CONECT   52   10                                                      
CONECT   53   11                                                      
CONECT   54   11                                                      
CONECT   55   12                                                      
CONECT   56   12                                                      
CONECT   57   13                                                      
CONECT   58   13                                                      
CONECT   59   14                                                      
CONECT   60   14                                                      
CONECT   61   15                                                      
CONECT   62   15                                                      
CONECT   63   16                                                      
CONECT   64   16                                                      
CONECT   65   17                                                      
CONECT   66   17                                                      
CONECT   67   18                                                      
CONECT   68   18                                                      
CONECT   69   19                                                      
CONECT   70   19                                                      
CONECT   71   21                                                      
CONECT   72   21                                                      
CONECT   73   22                                                      
CONECT   74   22                                                      
CONECT   75   23                                                      
CONECT   76   23                                                      
CONECT   77   24                                                      
CONECT   78   24                                                      
CONECT   79   29                                                      
CONECT   80   31                                                      
MASTER        0    0    0    0    0    0    0    0   80    0   80    0
END
