COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.046   4.438  -0.449  1.00  0.00           C  
HETATM    2  N   UNL     1      -2.661  -0.077   0.376  1.00  0.00           N  
HETATM    3  C   UNL     1       0.534   3.474  -0.219  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.022   1.660   0.081  1.00  0.00           C  
HETATM    5  C   UNL     1       0.033   0.754   0.156  1.00  0.00           C  
HETATM    6  C   UNL     1       1.347   1.212   0.042  1.00  0.00           C  
HETATM    7  C   UNL     1       3.335  -0.469   0.180  1.00  0.00           C  
HETATM    8  C   UNL     1       4.426  -1.392   0.255  1.00  0.00           C  
HETATM    9  C   UNL     1       6.811  -1.892   0.222  1.00  0.00           C  
HETATM   10  C   UNL     1       8.111  -1.146   0.072  1.00  0.00           C  
HETATM   11  C   UNL     1       8.835  -0.615   1.074  1.00  0.00           C  
HETATM   12  C   UNL     1       9.970  -0.013   0.485  1.00  0.00           C  
HETATM   13  C   UNL     1       9.873  -0.211  -0.842  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.412   1.184   0.201  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.285  -1.941   0.135  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.477  -2.893   1.040  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.047  -4.231   1.089  1.00  0.00           C  
HETATM   18  C   UNL     1       1.594   2.582  -0.147  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.061  -4.915  -0.294  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.235  -4.391  -1.075  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.857  -3.206  -1.984  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.906  -2.207  -1.297  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.958   0.278   0.903  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.605   1.718   1.162  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.822   2.623   1.103  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.256   2.865  -0.311  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.519   2.605  -1.342  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.186   2.023  -1.277  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.569   2.163   0.121  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.763   3.023  -0.107  1.00  0.00           C  
HETATM   31  C   UNL     1       2.439   0.288   0.117  1.00  0.00           C  
HETATM   32  N   UNL     1       5.694  -0.948   0.145  1.00  0.00           N  
HETATM   33  N   UNL     1      -3.976  -0.552   0.480  1.00  0.00           N  
HETATM   34  O   UNL     1       2.869   3.032  -0.259  1.00  0.00           O  
HETATM   35  O   UNL     1       4.210  -2.579   0.419  1.00  0.00           O  
HETATM   36  O   UNL     1       8.748  -0.903  -1.086  1.00  0.00           O  
HETATM   37  O   UNL     1      -6.090  -0.127   1.068  1.00  0.00           O  
HETATM   38  H   UNL     1       4.110   4.663  -0.523  1.00  0.00           H  
HETATM   39  H   UNL     1       2.545   4.746  -1.367  1.00  0.00           H  
HETATM   40  H   UNL     1       2.618   4.976   0.397  1.00  0.00           H  
HETATM   41  H   UNL     1       0.726   4.528  -0.360  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.164  -0.298   0.301  1.00  0.00           H  
HETATM   43  H   UNL     1       6.720  -2.629  -0.576  1.00  0.00           H  
HETATM   44  H   UNL     1       6.792  -2.399   1.188  1.00  0.00           H  
HETATM   45  H   UNL     1       8.594  -0.644   2.126  1.00  0.00           H  
HETATM   46  H   UNL     1      10.763   0.508   1.002  1.00  0.00           H  
HETATM   47  H   UNL     1      10.581   0.126  -1.584  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.351  -2.124   0.271  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.456  -2.958   0.662  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.451  -2.483   2.049  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.462  -4.839   1.778  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.070  -4.165   1.459  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.136  -4.687  -0.824  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.153  -5.994  -0.168  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.635  -5.195  -1.693  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.007  -4.067  -0.377  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.373  -3.591  -2.882  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.767  -2.680  -2.273  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.926  -1.266  -1.847  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.893  -2.608  -1.325  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.159   1.795   2.153  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.640   2.157   1.652  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.579   3.578   1.569  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.239   3.279  -0.479  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.924   2.830  -2.318  1.00  0.00           H  
HETATM   66  H   UNL     1      -4.244   0.966  -1.538  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.538   2.531  -1.991  1.00  0.00           H  
HETATM   68  H   UNL     1      -3.231   3.184   0.299  1.00  0.00           H  
HETATM   69  H   UNL     1      -1.583   3.723  -0.164  1.00  0.00           H  
HETATM   70  H   UNL     1       5.866  -0.002   0.014  1.00  0.00           H  
CONECT    1   34   38   39   40                                       
CONECT    2   14   14   33                                            
CONECT    3   30   30   18   41                                       
CONECT    4   30    5    5   14                                       
CONECT    5    4    4    6   42                                       
CONECT    6   18   18    5   31                                       
CONECT    7   31   31   31    8                                       
CONECT    8    7   35   35   32                                       
CONECT    9   32   10   43   44                                       
CONECT   10    9   11   11   36                                       
CONECT   11   10   10   12   45                                       
CONECT   12   11   13   13   46                                       
CONECT   13   36   12   12   47                                       
CONECT   14    4   29    2    2                                       
CONECT   15   33   22   16   48                                       
CONECT   16   15   17   49   50                                       
CONECT   17   16   19   51   52                                       
CONECT   18    3   34    6    6                                       
CONECT   19   20   17   53   54                                       
CONECT   20   21   19   55   56                                       
CONECT   21   22   20   57   58                                       
CONECT   22   15   21   59   60                                       
CONECT   23   24   33   37   37                                       
CONECT   24   29   25   23   61                                       
CONECT   25   26   24   62   63                                       
CONECT   26   27   27   25   64                                       
CONECT   27   28   26   26   65                                       
CONECT   28   27   29   66   67                                       
CONECT   29   28   14   24   68                                       
CONECT   30    3    3    4   69                                       
CONECT   31    6    7    7    7                                       
CONECT   32    8    9   70                                            
CONECT   33    2   23   15                                            
CONECT   34    1   18                                                 
CONECT   35    8    8                                                 
CONECT   36   10   13                                                 
CONECT   37   23   23                                                 
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    3                                                      
CONECT   42    5                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   16                                                      
CONECT   51   17                                                      
CONECT   52   17                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   24                                                      
CONECT   62   25                                                      
CONECT   63   25                                                      
CONECT   64   26                                                      
CONECT   65   27                                                      
CONECT   66   28                                                      
CONECT   67   28                                                      
CONECT   68   29                                                      
CONECT   69   30                                                      
CONECT   70   32                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
