COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      28.383 -13.182  14.154  1.00  0.00           C  
HETATM    2  C   UNL     1      27.098 -13.617  14.364  1.00  0.00           C  
HETATM    3  C   UNL     1      28.309 -12.313  13.007  1.00  0.00           C  
HETATM    4  C   UNL     1      24.910 -13.223  13.159  1.00  0.00           C  
HETATM    5  C   UNL     1      30.239 -10.284   9.287  1.00  0.00           C  
HETATM    6  C   UNL     1      28.785 -10.344   9.264  1.00  0.00           C  
HETATM    7  C   UNL     1      27.981  -9.876   8.238  1.00  0.00           C  
HETATM    8  C   UNL     1      24.554  -8.808   8.002  1.00  0.00           C  
HETATM    9  C   UNL     1      25.796  -8.905   7.443  1.00  0.00           C  
HETATM   10  C   UNL     1      26.603  -9.682   8.364  1.00  0.00           C  
HETATM   11  N   UNL     1      25.844 -10.149   9.409  1.00  0.00           N  
HETATM   12  C   UNL     1      24.565  -9.723   9.120  1.00  0.00           C  
HETATM   13  C   UNL     1      22.639 -12.453  12.390  1.00  0.00           C  
HETATM   14  C   UNL     1      22.243 -11.552  11.477  1.00  0.00           C  
HETATM   15  C   UNL     1      23.444 -10.978  10.894  1.00  0.00           C  
HETATM   16  N   UNL     1      24.573 -11.517  11.447  1.00  0.00           N  
HETATM   17  C   UNL     1      24.097 -12.435  12.362  1.00  0.00           C  
HETATM   18  C   UNL     1      23.445 -10.018   9.885  1.00  0.00           C  
HETATM   19  C   UNL     1      26.280 -13.026  13.320  1.00  0.00           C  
HETATM   20  N   UNL     1      27.025 -12.225  12.496  1.00  0.00           N  
HETATM   21  C   UNL     1      30.622 -10.782  10.491  1.00  0.00           C  
HETATM   22  C   UNL     1      29.418 -11.134  11.191  1.00  0.00           C  
HETATM   23  N   UNL     1      28.296 -10.879  10.438  1.00  0.00           N  
HETATM   24  C   UNL     1      29.402 -11.693  12.461  1.00  0.00           C  
HETATM   25  C   UNL     1      21.806 -13.315  13.289  1.00  0.00           C  
HETATM   26  C   UNL     1      21.500 -12.649  14.630  1.00  0.00           C  
HETATM   27  C   UNL     1      26.592 -14.553  15.409  1.00  0.00           C  
HETATM   28  C   UNL     1      26.023 -13.815  16.622  1.00  0.00           C  
HETATM   29  C   UNL     1      29.640 -13.470  14.925  1.00  0.00           C  
HETATM   30  C   UNL     1      30.452 -14.573  14.242  1.00  0.00           C  
HETATM   31  C   UNL     1      32.010 -10.935  11.042  1.00  0.00           C  
HETATM   32  C   UNL     1      32.496 -12.379  11.014  1.00  0.00           C  
HETATM   33  C   UNL     1      31.067  -9.743   8.163  1.00  0.00           C  
HETATM   34  C   UNL     1      31.577  -8.330   8.377  1.00  0.00           C  
HETATM   35  C   UNL     1      26.333  -8.198   6.241  1.00  0.00           C  
HETATM   36  C   UNL     1      26.977  -6.851   6.598  1.00  0.00           C  
HETATM   37  C   UNL     1      23.443  -7.823   7.706  1.00  0.00           C  
HETATM   38  C   UNL     1      23.052  -7.826   6.225  1.00  0.00           C  
HETATM   39  C   UNL     1      20.868 -11.123  11.079  1.00  0.00           C  
HETATM   40  C   UNL     1      20.314 -10.003  11.937  1.00  0.00           C  
HETATM   41 CO   UNL     1      26.424 -11.194  10.942  1.00  0.00          Co  
HETATM   42  H   UNL     1      24.452 -14.044  13.691  1.00  0.00           H  
HETATM   43  H   UNL     1      28.444  -9.649   7.289  1.00  0.00           H  
HETATM   44  H   UNL     1      22.531  -9.477   9.688  1.00  0.00           H  
HETATM   45  H   UNL     1      30.303 -11.636  13.053  1.00  0.00           H  
HETATM   46  H   UNL     1      20.856 -13.537  12.782  1.00  0.00           H  
HETATM   47  H   UNL     1      22.348 -14.253  13.478  1.00  0.00           H  
HETATM   48  H   UNL     1      20.888 -13.326  15.245  1.00  0.00           H  
HETATM   49  H   UNL     1      22.442 -12.429  15.153  1.00  0.00           H  
HETATM   50  H   UNL     1      20.949 -11.713  14.457  1.00  0.00           H  
HETATM   51  H   UNL     1      25.799 -15.177  14.971  1.00  0.00           H  
HETATM   52  H   UNL     1      27.422 -15.194  15.742  1.00  0.00           H  
HETATM   53  H   UNL     1      25.664 -14.546  17.362  1.00  0.00           H  
HETATM   54  H   UNL     1      26.809 -13.192  17.074  1.00  0.00           H  
HETATM   55  H   UNL     1      25.187 -13.176  16.303  1.00  0.00           H  
HETATM   56  H   UNL     1      30.248 -12.555  14.979  1.00  0.00           H  
HETATM   57  H   UNL     1      29.374 -13.794  15.942  1.00  0.00           H  
HETATM   58  H   UNL     1      31.366 -14.768  14.821  1.00  0.00           H  
HETATM   59  H   UNL     1      29.849 -15.492  14.188  1.00  0.00           H  
HETATM   60  H   UNL     1      30.724 -14.252  13.225  1.00  0.00           H  
HETATM   61  H   UNL     1      32.697 -10.320  10.442  1.00  0.00           H  
HETATM   62  H   UNL     1      32.016 -10.581  12.084  1.00  0.00           H  
HETATM   63  H   UNL     1      33.514 -12.432  11.428  1.00  0.00           H  
HETATM   64  H   UNL     1      31.822 -13.004  11.618  1.00  0.00           H  
HETATM   65  H   UNL     1      32.503 -12.743   9.976  1.00  0.00           H  
HETATM   66  H   UNL     1      30.454  -9.752   7.250  1.00  0.00           H  
HETATM   67  H   UNL     1      31.935 -10.404   8.028  1.00  0.00           H  
HETATM   68  H   UNL     1      32.172  -8.018   7.506  1.00  0.00           H  
HETATM   69  H   UNL     1      30.724  -7.647   8.502  1.00  0.00           H  
HETATM   70  H   UNL     1      32.206  -8.300   9.279  1.00  0.00           H  
HETATM   71  H   UNL     1      25.507  -8.020   5.537  1.00  0.00           H  
HETATM   72  H   UNL     1      27.090  -8.837   5.764  1.00  0.00           H  
HETATM   73  H   UNL     1      27.356  -6.371   5.683  1.00  0.00           H  
HETATM   74  H   UNL     1      26.227  -6.200   7.070  1.00  0.00           H  
HETATM   75  H   UNL     1      27.810  -7.017   7.297  1.00  0.00           H  
HETATM   76  H   UNL     1      23.781  -6.813   7.982  1.00  0.00           H  
HETATM   77  H   UNL     1      22.561  -8.091   8.306  1.00  0.00           H  
HETATM   78  H   UNL     1      22.245  -7.098   6.057  1.00  0.00           H  
HETATM   79  H   UNL     1      23.925  -7.552   5.615  1.00  0.00           H  
HETATM   80  H   UNL     1      22.706  -8.830   5.939  1.00  0.00           H  
HETATM   81  H   UNL     1      20.899 -10.779  10.035  1.00  0.00           H  
HETATM   82  H   UNL     1      20.195 -11.990  11.160  1.00  0.00           H  
HETATM   83  H   UNL     1      19.304  -9.739  11.589  1.00  0.00           H  
HETATM   84  H   UNL     1      20.266 -10.333  12.985  1.00  0.00           H  
HETATM   85  H   UNL     1      20.970  -9.123  11.859  1.00  0.00           H  
CONECT    1    3    2    2   29                                       
CONECT    2   19    1    1   27                                       
CONECT    3   24   24   20    1                                       
CONECT    4   17   17   19   42                                       
CONECT    5   33    6    6   21                                       
CONECT    6    7    5    5   23                                       
CONECT    7   10   10    6   43                                       
CONECT    8    9    9   37   12                                       
CONECT    9   35    8    8   10                                       
CONECT   10    9    7    7   11                                       
CONECT   11   10   12   12   41                                       
CONECT   12    8   11   11   18                                       
CONECT   13   14   14   17   25                                       
CONECT   14   15   39   13   13                                       
CONECT   15   18   18   16   14                                       
CONECT   16   15   41   17                                            
CONECT   17   16   13    4    4                                       
CONECT   18   12   15   15   44                                       
CONECT   19   20   20    4    2                                       
CONECT   20   41    3   19   19                                       
CONECT   21    5   31   22   22                                       
CONECT   22   23   21   21   24                                       
CONECT   23    6   41   22                                            
CONECT   24   22    3    3   45                                       
CONECT   25   13   26   46   47                                       
CONECT   26   25   48   49   50                                       
CONECT   27    2   28   51   52                                       
CONECT   28   27   53   54   55                                       
CONECT   29    1   30   56   57                                       
CONECT   30   29   58   59   60                                       
CONECT   31   21   32   61   62                                       
CONECT   32   31   63   64   65                                       
CONECT   33   34    5   66   67                                       
CONECT   34   33   68   69   70                                       
CONECT   35   36    9   71   72                                       
CONECT   36   35   73   74   75                                       
CONECT   37   38    8   76   77                                       
CONECT   38   37   78   79   80                                       
CONECT   39   14   40   81   82                                       
CONECT   40   39   83   84   85                                       
CONECT   41   11   23   16   20                                       
CONECT   42    4                                                      
CONECT   43    7                                                      
CONECT   44   18                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   28                                                      
CONECT   55   28                                                      
CONECT   56   29                                                      
CONECT   57   29                                                      
CONECT   58   30                                                      
CONECT   59   30                                                      
CONECT   60   30                                                      
CONECT   61   31                                                      
CONECT   62   31                                                      
CONECT   63   32                                                      
CONECT   64   32                                                      
CONECT   65   32                                                      
CONECT   66   33                                                      
CONECT   67   33                                                      
CONECT   68   34                                                      
CONECT   69   34                                                      
CONECT   70   34                                                      
CONECT   71   35                                                      
CONECT   72   35                                                      
CONECT   73   36                                                      
CONECT   74   36                                                      
CONECT   75   36                                                      
CONECT   76   37                                                      
CONECT   77   37                                                      
CONECT   78   38                                                      
CONECT   79   38                                                      
CONECT   80   38                                                      
CONECT   81   39                                                      
CONECT   82   39                                                      
CONECT   83   40                                                      
CONECT   84   40                                                      
CONECT   85   40                                                      
MASTER        0    0    0    0    0    0    0    0   85    0   85    0
END
