COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.305  -2.116  -1.471  1.00  0.00           C  
HETATM    2  N   UNL     1       4.099  -1.907  -3.096  1.00  0.00           N  
HETATM    3  O   UNL     1       2.251  -3.283  -1.776  1.00  0.00           O  
HETATM    4  N   UNL     1      -8.586   3.462  -0.449  1.00  0.00           N  
HETATM    5  C   UNL     1      -8.237   3.129   0.780  1.00  0.00           C  
HETATM    6  C   UNL     1      12.894   3.136   2.203  1.00  0.00           C  
HETATM    7  N   UNL     1      -7.238   2.311   1.034  1.00  0.00           N  
HETATM    8  C   UNL     1      -6.528   1.780   0.043  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.860   2.103  -1.283  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.935   2.980  -1.503  1.00  0.00           C  
HETATM   11  N   UNL     1      -8.309   3.335  -2.788  1.00  0.00           N  
HETATM   12  N   UNL     1      -5.994   1.438  -2.085  1.00  0.00           N  
HETATM   13  C   UNL     1      -5.172   0.744  -1.352  1.00  0.00           C  
HETATM   14  N   UNL     1      -5.460   0.922  -0.032  1.00  0.00           N  
HETATM   15  C   UNL     1       3.459  -1.267  -1.939  1.00  0.00           C  
HETATM   16  C   UNL     1       4.478  -1.122  -0.807  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.759   0.309   1.099  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.482  -0.984   1.554  1.00  0.00           C  
HETATM   19  O   UNL     1      -6.522  -0.685   2.488  1.00  0.00           O  
HETATM   20  C   UNL     1      -4.338  -1.773   2.235  1.00  0.00           C  
HETATM   21  O   UNL     1      -4.378  -1.590   3.652  1.00  0.00           O  
HETATM   22  C   UNL     1      -3.053  -1.157   1.648  1.00  0.00           C  
HETATM   23  O   UNL     1      -3.454  -0.159   0.695  1.00  0.00           O  
HETATM   24  C   UNL     1      -2.228  -2.240   0.951  1.00  0.00           C  
HETATM   25  O   UNL     1      -0.986  -1.685   0.512  1.00  0.00           O  
HETATM   26  O   UNL     1       9.918   2.495  -0.650  1.00  0.00           O  
HETATM   27  O   UNL     1      -0.470  -3.175  -1.459  1.00  0.00           O  
HETATM   28  O   UNL     1       0.707  -3.686   0.715  1.00  0.00           O  
HETATM   29  C   UNL     1       6.606  -0.016  -0.107  1.00  0.00           C  
HETATM   30  C   UNL     1       5.587  -0.161  -1.239  1.00  0.00           C  
HETATM   31  C   UNL     1       7.715   0.946  -0.539  1.00  0.00           C  
HETATM   32  N   UNL     1       8.691   1.084   0.544  1.00  0.00           N  
HETATM   33  O   UNL     1       1.335  -1.573  -0.718  1.00  0.00           O  
HETATM   34  C   UNL     1       9.762   1.887   0.388  1.00  0.00           C  
HETATM   35  C   UNL     1      11.875   2.991   1.071  1.00  0.00           C  
HETATM   36  C   UNL     1      10.766   2.030   1.503  1.00  0.00           C  
HETATM   37  P   UNL     1       0.133  -2.544  -0.264  1.00  0.00           P  
HETATM   38  H   UNL     1       4.448  -2.823  -2.855  1.00  0.00           H  
HETATM   39  H   UNL     1       3.465  -1.956  -3.879  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.793   3.543   1.609  1.00  0.00           H  
HETATM   41  H   UNL     1      13.684   3.821   1.895  1.00  0.00           H  
HETATM   42  H   UNL     1      12.398   3.529   3.091  1.00  0.00           H  
HETATM   43  H   UNL     1      13.326   2.161   2.429  1.00  0.00           H  
HETATM   44  H   UNL     1      -9.053   3.941  -2.927  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.826   2.977  -3.549  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.378   0.119  -1.734  1.00  0.00           H  
HETATM   47  H   UNL     1       3.092  -0.282  -2.226  1.00  0.00           H  
HETATM   48  H   UNL     1       3.982  -0.730   0.080  1.00  0.00           H  
HETATM   49  H   UNL     1       4.910  -2.097  -0.581  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.677   1.015   1.926  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.877  -1.531   0.697  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.003  -1.463   2.802  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.403  -2.832   1.986  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.192  -1.908   4.066  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.466  -0.696   2.443  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.035  -3.055   1.648  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.780  -2.620   0.091  1.00  0.00           H  
HETATM   58  H   UNL     1       6.110   0.377   0.780  1.00  0.00           H  
HETATM   59  H   UNL     1       7.038  -0.991   0.119  1.00  0.00           H  
HETATM   60  H   UNL     1       6.083  -0.553  -2.127  1.00  0.00           H  
HETATM   61  H   UNL     1       5.155   0.814  -1.466  1.00  0.00           H  
HETATM   62  H   UNL     1       8.211   0.553  -1.427  1.00  0.00           H  
HETATM   63  H   UNL     1       7.283   1.920  -0.766  1.00  0.00           H  
HETATM   64  H   UNL     1       8.566   0.598   1.375  1.00  0.00           H  
HETATM   65  H   UNL     1      11.443   3.966   0.845  1.00  0.00           H  
HETATM   66  H   UNL     1      12.371   2.599   0.183  1.00  0.00           H  
HETATM   67  H   UNL     1      10.270   2.422   2.391  1.00  0.00           H  
HETATM   68  H   UNL     1      11.198   1.055   1.729  1.00  0.00           H  
HETATM   69  H   UNL     1       1.118  -3.343   1.521  1.00  0.00           H  
CONECT    1    3    3   15   33                                       
CONECT    2   15   38   39                                            
CONECT    3    1    1                                                 
CONECT    4    5    5   10                                            
CONECT    5    4    4    7   40                                       
CONECT    6   35   41   42   43                                       
CONECT    7    5    8    8                                            
CONECT    8    7    7    9   14                                       
CONECT    9    8   10   10   12                                       
CONECT   10    4    9    9   11                                       
CONECT   11   10   44   45                                            
CONECT   12    9   13   13                                            
CONECT   13   12   12   14   46                                       
CONECT   14    8   13   17                                            
CONECT   15    1    2   16   47                                       
CONECT   16   15   30   48   49                                       
CONECT   17   14   18   23   50                                       
CONECT   18   17   19   20   51                                       
CONECT   19   18   52                                                 
CONECT   20   18   21   22   53                                       
CONECT   21   20   54                                                 
CONECT   22   20   23   24   55                                       
CONECT   23   17   22                                                 
CONECT   24   22   25   56   57                                       
CONECT   25   24   37                                                 
CONECT   26   34   34                                                 
CONECT   27   37   37                                                 
CONECT   28   37   69                                                 
CONECT   29   30   31   58   59                                       
CONECT   30   16   29   60   61                                       
CONECT   31   29   32   62   63                                       
CONECT   32   31   34   64                                            
CONECT   33    1   37                                                 
CONECT   34   26   26   32   36                                       
CONECT   35    6   36   65   66                                       
CONECT   36   34   35   67   68                                       
CONECT   37   25   27   27   28                                       
CONECT   37   33                                                      
CONECT   38    2                                                      
CONECT   39    2                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    6                                                      
CONECT   44   11                                                      
CONECT   45   11                                                      
CONECT   46   13                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   21                                                      
CONECT   55   22                                                      
CONECT   56   24                                                      
CONECT   57   24                                                      
CONECT   58   29                                                      
CONECT   59   29                                                      
CONECT   60   30                                                      
CONECT   61   30                                                      
CONECT   62   31                                                      
CONECT   63   31                                                      
CONECT   64   32                                                      
CONECT   65   35                                                      
CONECT   66   35                                                      
CONECT   67   36                                                      
CONECT   68   36                                                      
CONECT   69   28                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
