COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.967  -0.667  -0.276  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.222  -0.013  -0.231  1.00  0.00           C  
HETATM    3  O   UNL     1      -3.915  -1.884  -0.274  1.00  0.00           O  
HETATM    4  C   UNL     1      -6.366  -0.742  -0.186  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.617  -0.090  -0.142  1.00  0.00           C  
HETATM    6  C   UNL     1      -8.758  -0.817  -0.098  1.00  0.00           C  
HETATM    7  C   UNL     1     -10.060  -0.139  -0.051  1.00  0.00           C  
HETATM    8  C   UNL     1     -11.242  -0.888  -0.005  1.00  0.00           C  
HETATM    9  C   UNL     1     -12.462  -0.245   0.038  1.00  0.00           C  
HETATM   10  C   UNL     1     -14.552   0.372   0.528  1.00  0.00           C  
HETATM   11  C   UNL     1     -12.518   1.150   0.037  1.00  0.00           C  
HETATM   12  C   UNL     1     -11.346   1.893  -0.008  1.00  0.00           C  
HETATM   13  C   UNL     1     -10.123   1.260  -0.047  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.533  -0.620  -0.378  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.415   0.423  -0.428  1.00  0.00           C  
HETATM   16  C   UNL     1       0.940  -0.284  -0.482  1.00  0.00           C  
HETATM   17  C   UNL     1       2.058   0.760  -0.532  1.00  0.00           C  
HETATM   18  C   UNL     1       3.414   0.053  -0.587  1.00  0.00           C  
HETATM   19  C   UNL     1       4.531   1.096  -0.637  1.00  0.00           C  
HETATM   20  C   UNL     1       7.744   1.217  -1.032  1.00  0.00           C  
HETATM   21  C   UNL     1       8.931   0.563  -1.303  1.00  0.00           C  
HETATM   22  C   UNL     1      10.081   1.291  -1.546  1.00  0.00           C  
HETATM   23  C   UNL     1      10.044   2.672  -1.516  1.00  0.00           C  
HETATM   24  C   UNL     1       8.856   3.326  -1.245  1.00  0.00           C  
HETATM   25  C   UNL     1       7.705   2.598  -1.009  1.00  0.00           C  
HETATM   26  C   UNL     1       6.290  -1.617  -0.442  1.00  0.00           C  
HETATM   27  C   UNL     1       7.501  -2.205  -0.127  1.00  0.00           C  
HETATM   28  C   UNL     1       7.575  -3.571   0.072  1.00  0.00           C  
HETATM   29  C   UNL     1       6.438  -4.349  -0.043  1.00  0.00           C  
HETATM   30  C   UNL     1       5.227  -3.760  -0.357  1.00  0.00           C  
HETATM   31  C   UNL     1       5.153  -2.395  -0.557  1.00  0.00           C  
HETATM   32  C   UNL     1       6.404   0.504   1.134  1.00  0.00           C  
HETATM   33  C   UNL     1       5.297   0.551   1.961  1.00  0.00           C  
HETATM   34  C   UNL     1       5.457   0.752   3.319  1.00  0.00           C  
HETATM   35  C   UNL     1       6.723   0.906   3.851  1.00  0.00           C  
HETATM   36  C   UNL     1       7.831   0.859   3.024  1.00  0.00           C  
HETATM   37  C   UNL     1       7.671   0.653   1.667  1.00  0.00           C  
HETATM   38  N   UNL     1      -2.831   0.057  -0.325  1.00  0.00           N  
HETATM   39  O   UNL     1     -13.738  -0.731   0.087  1.00  0.00           O  
HETATM   40  O   UNL     1     -13.826   1.533   0.084  1.00  0.00           O  
HETATM   41  P   UNL     1       6.188   0.232  -0.703  1.00  0.00           P  
HETATM   42  H   UNL     1      -5.269   1.066  -0.232  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.320  -1.821  -0.185  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.663   0.989  -0.143  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.711  -1.896  -0.097  1.00  0.00           H  
HETATM   46  H   UNL     1     -11.198  -1.967  -0.005  1.00  0.00           H  
HETATM   47  H   UNL     1     -15.535   0.333   0.059  1.00  0.00           H  
HETATM   48  H   UNL     1     -14.646   0.368   1.614  1.00  0.00           H  
HETATM   49  H   UNL     1     -11.393   2.972  -0.009  1.00  0.00           H  
HETATM   50  H   UNL     1      -9.214   1.842  -0.082  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.486  -1.247  -1.268  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.411  -1.241   0.510  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.538   1.044  -1.315  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.463   1.049   0.463  1.00  0.00           H  
HETATM   55  H   UNL     1       1.062  -0.905   0.405  1.00  0.00           H  
HETATM   56  H   UNL     1       0.988  -0.910  -1.373  1.00  0.00           H  
HETATM   57  H   UNL     1       1.936   1.381  -1.420  1.00  0.00           H  
HETATM   58  H   UNL     1       2.010   1.386   0.359  1.00  0.00           H  
HETATM   59  H   UNL     1       3.536  -0.568   0.301  1.00  0.00           H  
HETATM   60  H   UNL     1       3.461  -0.574  -1.477  1.00  0.00           H  
HETATM   61  H   UNL     1       4.410   1.717  -1.524  1.00  0.00           H  
HETATM   62  H   UNL     1       4.484   1.722   0.254  1.00  0.00           H  
HETATM   63  H   UNL     1       8.961  -0.516  -1.326  1.00  0.00           H  
HETATM   64  H   UNL     1      11.009   0.780  -1.757  1.00  0.00           H  
HETATM   65  H   UNL     1      10.942   3.241  -1.705  1.00  0.00           H  
HETATM   66  H   UNL     1       8.826   4.405  -1.227  1.00  0.00           H  
HETATM   67  H   UNL     1       6.778   3.109  -0.797  1.00  0.00           H  
HETATM   68  H   UNL     1       8.389  -1.597  -0.038  1.00  0.00           H  
HETATM   69  H   UNL     1       8.521  -4.030   0.316  1.00  0.00           H  
HETATM   70  H   UNL     1       6.496  -5.416   0.112  1.00  0.00           H  
HETATM   71  H   UNL     1       4.339  -4.368  -0.447  1.00  0.00           H  
HETATM   72  H   UNL     1       4.207  -1.935  -0.802  1.00  0.00           H  
HETATM   73  H   UNL     1       4.308   0.430   1.545  1.00  0.00           H  
HETATM   74  H   UNL     1       4.592   0.789   3.965  1.00  0.00           H  
HETATM   75  H   UNL     1       6.848   1.064   4.912  1.00  0.00           H  
HETATM   76  H   UNL     1       8.820   0.980   3.440  1.00  0.00           H  
HETATM   77  H   UNL     1       8.536   0.612   1.022  1.00  0.00           H  
HETATM   78  H   UNL     1      -2.873   1.026  -0.326  1.00  0.00           H  
HETATM   79  H   UNL     1       6.019   0.018  -2.148  1.00  0.00           H  
CONECT    1    2    3    3   38                                       
CONECT    2    4    4    1   42                                       
CONECT    3    1    1                                                 
CONECT    4    5    2    2   43                                       
CONECT    5    6    6    4   44                                       
CONECT    6    7    5    5   45                                       
CONECT    7   13   13    8    6                                       
CONECT    8    9    9    7   46                                       
CONECT    9   11   39    8    8                                       
CONECT   10   40   39   47   48                                       
CONECT   11   40   12   12    9                                       
CONECT   12   11   11   13   49                                       
CONECT   13   12    7    7   50                                       
CONECT   14   15   38   51   52                                       
CONECT   15   16   14   53   54                                       
CONECT   16   17   15   55   56                                       
CONECT   17   18   16   57   58                                       
CONECT   18   17   19   59   60                                       
CONECT   19   18   41   61   62                                       
CONECT   20   25   41   21   21                                       
CONECT   21   20   20   22   63                                       
CONECT   22   23   23   21   64                                       
CONECT   23   24   22   22   65                                       
CONECT   24   25   25   23   66                                       
CONECT   25   24   24   20   67                                       
CONECT   26   41   27   27   31                                       
CONECT   27   26   26   28   68                                       
CONECT   28   27   29   29   69                                       
CONECT   29   28   28   30   70                                       
CONECT   30   31   31   29   71                                       
CONECT   31   26   30   30   72                                       
CONECT   32   33   41   37   37                                       
CONECT   33   34   34   32   73                                       
CONECT   34   33   33   35   74                                       
CONECT   35   34   36   36   75                                       
CONECT   36   35   35   37   76                                       
CONECT   37   32   32   36   77                                       
CONECT   38    1   14   78                                            
CONECT   39   10    9                                                 
CONECT   40   10   11                                                 
CONECT   41   19   20   32   26                                       
CONECT   41   79                                                      
CONECT   42    2                                                      
CONECT   43    4                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    8                                                      
CONECT   47   10                                                      
CONECT   48   10                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   14                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   15                                                      
CONECT   55   16                                                      
CONECT   56   16                                                      
CONECT   57   17                                                      
CONECT   58   17                                                      
CONECT   59   18                                                      
CONECT   60   18                                                      
CONECT   61   19                                                      
CONECT   62   19                                                      
CONECT   63   21                                                      
CONECT   64   22                                                      
CONECT   65   23                                                      
CONECT   66   24                                                      
CONECT   67   25                                                      
CONECT   68   27                                                      
CONECT   69   28                                                      
CONECT   70   29                                                      
CONECT   71   30                                                      
CONECT   72   31                                                      
CONECT   73   33                                                      
CONECT   74   34                                                      
CONECT   75   35                                                      
CONECT   76   36                                                      
CONECT   77   37                                                      
CONECT   78   38                                                      
CONECT   79   41                                                      
MASTER        0    0    0    0    0    0    0    0   79    0   79    0
END
