COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.486  -0.739  -5.192  1.00  0.00           C  
HETATM    2  C   UNL     1       2.255  -0.310  -2.874  1.00  0.00           C  
HETATM    3  O   UNL     1       2.395  -1.461  -2.516  1.00  0.00           O  
HETATM    4  C   UNL     1       2.447   0.070  -4.319  1.00  0.00           C  
HETATM    5  N   UNL     1       1.921   0.658  -1.975  1.00  0.00           N  
HETATM    6  C   UNL     1       1.746   0.211  -0.577  1.00  0.00           C  
HETATM    7  C   UNL     1       0.439   0.751  -0.055  1.00  0.00           C  
HETATM    8  O   UNL     1       0.394   1.857   0.439  1.00  0.00           O  
HETATM    9  C   UNL     1       2.900   0.738   0.278  1.00  0.00           C  
HETATM   10  C   UNL     1       2.773   0.188   1.700  1.00  0.00           C  
HETATM   11  C   UNL     1       4.230   0.285  -0.326  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.680   0.005  -0.136  1.00  0.00           N  
HETATM   13  C   UNL     1      -1.954   0.523   0.368  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.073   0.151  -0.609  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.486  -0.026  -1.986  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.057   1.077  -2.700  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.512   0.918  -3.959  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.375  -1.291  -2.532  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.831  -1.456  -3.792  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.395  -0.350  -4.508  1.00  0.00           C  
HETATM   21  O   UNL     1      -0.855  -0.509  -5.744  1.00  0.00           O  
HETATM   22  C   UNL     1       0.395   0.181  -5.740  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.248  -0.090   1.738  1.00  0.00           C  
HETATM   24  O   UNL     1      -3.492   0.413   2.228  1.00  0.00           O  
HETATM   25  C   UNL     1      -1.129   0.279   2.713  1.00  0.00           C  
HETATM   26  N   UNL     1      -1.411  -0.309   4.029  1.00  0.00           N  
HETATM   27  C   UNL     1      -0.305   0.081   4.913  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.536  -0.502   6.308  1.00  0.00           C  
HETATM   29  C   UNL     1       0.616  -0.095   7.229  1.00  0.00           C  
HETATM   30  C   UNL     1       0.384  -0.678   8.624  1.00  0.00           C  
HETATM   31  C   UNL     1       1.933  -0.631   6.664  1.00  0.00           C  
HETATM   32  H   UNL     1       1.030  -1.528  -4.595  1.00  0.00           H  
HETATM   33  H   UNL     1       2.036  -1.184  -6.022  1.00  0.00           H  
HETATM   34  H   UNL     1       3.474  -0.140  -4.617  1.00  0.00           H  
HETATM   35  H   UNL     1       2.244   1.133  -4.445  1.00  0.00           H  
HETATM   36  H   UNL     1       1.805   1.585  -2.237  1.00  0.00           H  
HETATM   37  H   UNL     1       1.732  -0.877  -0.540  1.00  0.00           H  
HETATM   38  H   UNL     1       2.865   1.827   0.305  1.00  0.00           H  
HETATM   39  H   UNL     1       3.595   0.563   2.309  1.00  0.00           H  
HETATM   40  H   UNL     1       1.825   0.511   2.131  1.00  0.00           H  
HETATM   41  H   UNL     1       2.808  -0.900   1.673  1.00  0.00           H  
HETATM   42  H   UNL     1       4.227  -0.798  -0.441  1.00  0.00           H  
HETATM   43  H   UNL     1       4.365   0.754  -1.301  1.00  0.00           H  
HETATM   44  H   UNL     1       5.047   0.578   0.333  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.643  -0.879  -0.531  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.896   1.607   0.459  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.542  -0.778  -0.290  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.817   0.947  -0.631  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.149   2.065  -2.272  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.178   1.781  -4.517  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.714  -2.152  -1.974  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.745  -2.444  -4.218  1.00  0.00           H  
HETATM   53  H   UNL     1       0.648   0.480  -6.758  1.00  0.00           H  
HETATM   54  H   UNL     1       0.318   1.068  -5.110  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.306  -1.174   1.646  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.398   1.373   2.295  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.070   1.364   2.806  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.180  -0.104   2.339  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.353  -1.310   3.917  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.257   1.168   4.977  1.00  0.00           H  
HETATM   61  H   UNL     1       0.633  -0.300   4.510  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.584  -1.589   6.244  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.474  -0.120   6.710  1.00  0.00           H  
HETATM   64  H   UNL     1       0.663   0.991   7.292  1.00  0.00           H  
HETATM   65  H   UNL     1       1.205  -0.388   9.280  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.553  -0.296   9.026  1.00  0.00           H  
HETATM   67  H   UNL     1       0.337  -1.765   8.560  1.00  0.00           H  
HETATM   68  H   UNL     1       1.885  -1.718   6.600  1.00  0.00           H  
HETATM   69  H   UNL     1       2.098  -0.215   5.670  1.00  0.00           H  
HETATM   70  H   UNL     1       2.754  -0.341   7.320  1.00  0.00           H  
CONECT    1    4   22   32   33                                       
CONECT    2    3    3    4    5                                       
CONECT    3    2    2                                                 
CONECT    4    1    2   34   35                                       
CONECT    5    2    6   36                                            
CONECT    6    5    7    9   37                                       
CONECT    7    6    8    8   12                                       
CONECT    8    7    7                                                 
CONECT    9    6   10   11   38                                       
CONECT   10    9   39   40   41                                       
CONECT   11    9   42   43   44                                       
CONECT   12    7   13   45                                            
CONECT   13   12   14   23   46                                       
CONECT   14   13   15   47   48                                       
CONECT   15   14   16   18   18                                       
CONECT   16   15   17   17   49                                       
CONECT   17   16   16   20   50                                       
CONECT   18   15   15   19   51                                       
CONECT   19   18   20   20   52                                       
CONECT   20   17   19   19   21                                       
CONECT   21   20   22                                                 
CONECT   22    1   21   53   54                                       
CONECT   23   13   24   25   55                                       
CONECT   24   23   56                                                 
CONECT   25   23   26   57   58                                       
CONECT   26   25   27   59                                            
CONECT   27   26   28   60   61                                       
CONECT   28   27   29   62   63                                       
CONECT   29   28   30   31   64                                       
CONECT   30   29   65   66   67                                       
CONECT   31   29   68   69   70                                       
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   14                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   22                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   25                                                      
CONECT   58   25                                                      
CONECT   59   26                                                      
CONECT   60   27                                                      
CONECT   61   27                                                      
CONECT   62   28                                                      
CONECT   63   28                                                      
CONECT   64   29                                                      
CONECT   65   30                                                      
CONECT   66   30                                                      
CONECT   67   30                                                      
CONECT   68   31                                                      
CONECT   69   31                                                      
CONECT   70   31                                                      
MASTER        0    0    0    0    0    0    0    0   70    0   70    0
END
