COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -8.532  -0.659  -1.745  1.00  0.00           O  
HETATM    2  C   UNL     1       1.520   1.564   0.525  1.00  0.00           C  
HETATM    3  O   UNL     1      -8.040  -1.777   0.583  1.00  0.00           O  
HETATM    4  C   UNL     1       1.812  -3.159   0.440  1.00  0.00           C  
HETATM    5  N   UNL     1       0.995   0.366   0.874  1.00  0.00           N  
HETATM    6  C   UNL     1       3.169  -3.097   0.159  1.00  0.00           C  
HETATM    7  C   UNL     1       3.137  -0.708   0.397  1.00  0.00           C  
HETATM    8  N   UNL     1       0.805   2.646   0.718  1.00  0.00           N  
HETATM    9  C   UNL     1       1.760  -0.784   0.649  1.00  0.00           C  
HETATM   10  C   UNL     1       3.842  -1.885   0.119  1.00  0.00           C  
HETATM   11  C   UNL     1       1.105  -2.004   0.675  1.00  0.00           C  
HETATM   12  C   UNL     1       2.886   1.632  -0.068  1.00  0.00           C  
HETATM   13  N   UNL     1       3.757   0.555   0.449  1.00  0.00           N  
HETATM   14  C   UNL     1       1.325   3.866   0.541  1.00  0.00           C  
HETATM   15  N   UNL     1       2.656   4.039   0.460  1.00  0.00           N  
HETATM   16  C   UNL     1       3.472   2.994   0.219  1.00  0.00           C  
HETATM   17  C   UNL     1       4.863   0.600  -0.548  1.00  0.00           C  
HETATM   18  C   UNL     1       5.881  -0.453  -0.232  1.00  0.00           C  
HETATM   19  C   UNL     1       5.295  -1.863  -0.270  1.00  0.00           C  
HETATM   20  C   UNL     1       1.124  -4.500   0.484  1.00  0.00           C  
HETATM   21  C   UNL     1       3.803  -4.445  -0.091  1.00  0.00           C  
HETATM   22  C   UNL     1       6.126  -2.673   0.743  1.00  0.00           C  
HETATM   23  C   UNL     1       5.522  -2.427  -1.672  1.00  0.00           C  
HETATM   24  O   UNL     1       0.592   4.831   0.481  1.00  0.00           O  
HETATM   25  O   UNL     1       4.667   3.171   0.258  1.00  0.00           O  
HETATM   26  C   UNL     1      -0.352   0.314   1.451  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.382   0.158   0.330  1.00  0.00           C  
HETATM   28  O   UNL     1      -1.288   1.271  -0.562  1.00  0.00           O  
HETATM   29  C   UNL     1      -2.787   0.104   0.932  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.817  -0.052  -0.188  1.00  0.00           C  
HETATM   31  O   UNL     1      -3.723   1.061  -1.080  1.00  0.00           O  
HETATM   32  O   UNL     1      -2.881  -1.009   1.824  1.00  0.00           O  
HETATM   33  C   UNL     1      -5.222  -0.106   0.414  1.00  0.00           C  
HETATM   34  O   UNL     1      -6.174  -0.368  -0.619  1.00  0.00           O  
HETATM   35  P   UNL     1      -7.755  -0.492  -0.345  1.00  0.00           P  
HETATM   36  O   UNL     1      -8.233   0.728   0.343  1.00  0.00           O  
HETATM   37  C   UNL     1       2.896   1.457  -1.603  1.00  0.00           C  
HETATM   38  C   UNL     1       4.079   0.472  -1.862  1.00  0.00           C  
HETATM   39  C   UNL     1       1.582   0.887  -2.126  1.00  0.00           C  
HETATM   40  H   UNL     1      -9.491  -0.739  -1.655  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.751  -2.614   0.195  1.00  0.00           H  
HETATM   42  H   UNL     1       0.046  -2.081   0.866  1.00  0.00           H  
HETATM   43  H   UNL     1       3.031   4.927   0.550  1.00  0.00           H  
HETATM   44  H   UNL     1       5.352   1.577  -0.524  1.00  0.00           H  
HETATM   45  H   UNL     1       6.703  -0.400  -0.953  1.00  0.00           H  
HETATM   46  H   UNL     1       6.294  -0.277   0.766  1.00  0.00           H  
HETATM   47  H   UNL     1       0.850  -4.801  -0.527  1.00  0.00           H  
HETATM   48  H   UNL     1       1.798  -5.241   0.914  1.00  0.00           H  
HETATM   49  H   UNL     1       0.226  -4.428   1.097  1.00  0.00           H  
HETATM   50  H   UNL     1       3.300  -4.933  -0.925  1.00  0.00           H  
HETATM   51  H   UNL     1       4.858  -4.311  -0.330  1.00  0.00           H  
HETATM   52  H   UNL     1       3.708  -5.062   0.803  1.00  0.00           H  
HETATM   53  H   UNL     1       5.756  -3.697   0.781  1.00  0.00           H  
HETATM   54  H   UNL     1       7.172  -2.675   0.435  1.00  0.00           H  
HETATM   55  H   UNL     1       6.039  -2.219   1.730  1.00  0.00           H  
HETATM   56  H   UNL     1       5.317  -3.497  -1.671  1.00  0.00           H  
HETATM   57  H   UNL     1       4.854  -1.929  -2.376  1.00  0.00           H  
HETATM   58  H   UNL     1       6.556  -2.255  -1.970  1.00  0.00           H  
HETATM   59  H   UNL     1      -0.424  -0.534   2.131  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.548   1.236   1.998  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.186  -0.764  -0.218  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.451   2.126  -0.141  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.983   1.026   1.480  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.621  -0.974  -0.736  1.00  0.00           H  
HETATM   65  H   UNL     1      -3.886   1.916  -0.660  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.718  -1.864   1.404  1.00  0.00           H  
HETATM   67  H   UNL     1      -5.268  -0.900   1.160  1.00  0.00           H  
HETATM   68  H   UNL     1      -5.452   0.849   0.886  1.00  0.00           H  
HETATM   69  H   UNL     1       3.109   2.418  -2.083  1.00  0.00           H  
HETATM   70  H   UNL     1       4.672   0.804  -2.711  1.00  0.00           H  
HETATM   71  H   UNL     1       3.694  -0.532  -2.013  1.00  0.00           H  
HETATM   72  H   UNL     1       0.766   1.561  -1.867  1.00  0.00           H  
HETATM   73  H   UNL     1       1.637   0.782  -3.209  1.00  0.00           H  
HETATM   74  H   UNL     1       1.404  -0.089  -1.674  1.00  0.00           H  
CONECT    1   35   40                                                 
CONECT    2    5   12    8    8                                       
CONECT    3   35   41                                                 
CONECT    4   20    6    6   11                                       
CONECT    5    9   26    2                                            
CONECT    6   21    4    4   10                                       
CONECT    7   10   10    9   13                                       
CONECT    8    2    2   14                                            
CONECT    9   11   11    7    5                                       
CONECT   10    6   19    7    7                                       
CONECT   11    4    9    9   42                                       
CONECT   12   13    2   37   16                                       
CONECT   13    7   17   12                                            
CONECT   14    8   15   24   24                                       
CONECT   15   16   14   43                                            
CONECT   16   12   25   25   15                                       
CONECT   17   18   13   38   44                                       
CONECT   18   19   17   45   46                                       
CONECT   19   23   22   10   18                                       
CONECT   20    4   47   48   49                                       
CONECT   21    6   50   51   52                                       
CONECT   22   19   53   54   55                                       
CONECT   23   19   56   57   58                                       
CONECT   24   14   14                                                 
CONECT   25   16   16                                                 
CONECT   26    5   27   59   60                                       
CONECT   27   28   26   29   61                                       
CONECT   28   27   62                                                 
CONECT   29   27   30   32   63                                       
CONECT   30   29   31   33   64                                       
CONECT   31   30   65                                                 
CONECT   32   29   66                                                 
CONECT   33   30   34   67   68                                       
CONECT   34   33   35                                                 
CONECT   35   34   36   36    1                                       
CONECT   35    3                                                      
CONECT   36   35   35                                                 
CONECT   37   38   12   39   69                                       
CONECT   38   17   37   70   71                                       
CONECT   39   37   72   73   74                                       
CONECT   40    1                                                      
CONECT   41    3                                                      
CONECT   42   11                                                      
CONECT   43   15                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   21                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   22                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   23                                                      
CONECT   58   23                                                      
CONECT   59   26                                                      
CONECT   60   26                                                      
CONECT   61   27                                                      
CONECT   62   28                                                      
CONECT   63   29                                                      
CONECT   64   30                                                      
CONECT   65   31                                                      
CONECT   66   32                                                      
CONECT   67   33                                                      
CONECT   68   33                                                      
CONECT   69   37                                                      
CONECT   70   38                                                      
CONECT   71   38                                                      
CONECT   72   39                                                      
CONECT   73   39                                                      
CONECT   74   39                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
