COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      10.446   3.672   1.021  1.00  0.00           C  
HETATM    2  C   UNL     1      11.414   2.506   0.816  1.00  0.00           C  
HETATM    3  C   UNL     1      12.250   2.752  -0.442  1.00  0.00           C  
HETATM    4  C   UNL     1      12.339   2.391   2.029  1.00  0.00           C  
HETATM    5  C   UNL     1      10.621   1.207   0.654  1.00  0.00           C  
HETATM    6  C   UNL     1       9.807   1.265  -0.640  1.00  0.00           C  
HETATM    7  C   UNL     1       9.288   2.688  -0.853  1.00  0.00           C  
HETATM    8  C   UNL     1      10.694   0.862  -1.819  1.00  0.00           C  
HETATM    9  C   UNL     1       8.640   0.315  -0.541  1.00  0.00           C  
HETATM   10  C   UNL     1       7.757   0.195  -1.599  1.00  0.00           C  
HETATM   11  C   UNL     1       6.688  -0.675  -1.511  1.00  0.00           C  
HETATM   12  C   UNL     1       8.458  -0.438   0.603  1.00  0.00           C  
HETATM   13  C   UNL     1       7.391  -1.310   0.696  1.00  0.00           C  
HETATM   14  C   UNL     1       6.500  -1.428  -0.361  1.00  0.00           C  
HETATM   15  O   UNL     1       5.449  -2.285  -0.273  1.00  0.00           O  
HETATM   16  C   UNL     1       4.572  -2.354  -1.400  1.00  0.00           C  
HETATM   17  C   UNL     1       3.458  -3.364  -1.117  1.00  0.00           C  
HETATM   18  O   UNL     1       2.649  -2.892  -0.038  1.00  0.00           O  
HETATM   19  C   UNL     1       1.573  -3.766   0.308  1.00  0.00           C  
HETATM   20  C   UNL     1       0.779  -3.163   1.469  1.00  0.00           C  
HETATM   21  O   UNL     1       0.158  -1.950   1.042  1.00  0.00           O  
HETATM   22  C   UNL     1      -0.613  -1.303   2.056  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.228  -0.021   1.490  1.00  0.00           C  
HETATM   24  O   UNL     1      -2.162  -0.356   0.462  1.00  0.00           O  
HETATM   25  C   UNL     1      -2.797   0.776  -0.137  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.771   0.302  -1.218  1.00  0.00           C  
HETATM   27  O   UNL     1      -4.826  -0.448  -0.613  1.00  0.00           O  
HETATM   28  C   UNL     1      -5.795  -0.940  -1.540  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.872  -1.723  -0.786  1.00  0.00           C  
HETATM   30  O   UNL     1      -7.589  -0.837   0.076  1.00  0.00           O  
HETATM   31  C   UNL     1      -8.623  -1.472   0.831  1.00  0.00           C  
HETATM   32  C   UNL     1      -9.320  -0.434   1.714  1.00  0.00           C  
HETATM   33  O   UNL     1      -9.987   0.523   0.889  1.00  0.00           O  
HETATM   34  C   UNL     1     -10.673   1.542   1.618  1.00  0.00           C  
HETATM   35  C   UNL     1     -11.347   2.505   0.639  1.00  0.00           C  
HETATM   36  O   UNL     1     -12.363   1.811  -0.088  1.00  0.00           O  
HETATM   37  H   UNL     1       9.543   3.313   1.515  1.00  0.00           H  
HETATM   38  H   UNL     1      10.920   4.433   1.640  1.00  0.00           H  
HETATM   39  H   UNL     1      10.184   4.102   0.054  1.00  0.00           H  
HETATM   40  H   UNL     1      13.140   3.325  -0.180  1.00  0.00           H  
HETATM   41  H   UNL     1      12.548   1.797  -0.873  1.00  0.00           H  
HETATM   42  H   UNL     1      11.659   3.310  -1.168  1.00  0.00           H  
HETATM   43  H   UNL     1      11.744   2.215   2.925  1.00  0.00           H  
HETATM   44  H   UNL     1      13.029   1.560   1.882  1.00  0.00           H  
HETATM   45  H   UNL     1      12.904   3.316   2.144  1.00  0.00           H  
HETATM   46  H   UNL     1      11.310   0.363   0.613  1.00  0.00           H  
HETATM   47  H   UNL     1       9.948   1.085   1.503  1.00  0.00           H  
HETATM   48  H   UNL     1      10.101   3.321  -1.211  1.00  0.00           H  
HETATM   49  H   UNL     1       8.486   2.676  -1.590  1.00  0.00           H  
HETATM   50  H   UNL     1       8.910   3.083   0.090  1.00  0.00           H  
HETATM   51  H   UNL     1      11.379   0.075  -1.506  1.00  0.00           H  
HETATM   52  H   UNL     1      10.070   0.498  -2.635  1.00  0.00           H  
HETATM   53  H   UNL     1      11.264   1.728  -2.156  1.00  0.00           H  
HETATM   54  H   UNL     1       7.904   0.782  -2.493  1.00  0.00           H  
HETATM   55  H   UNL     1       5.998  -0.768  -2.337  1.00  0.00           H  
HETATM   56  H   UNL     1       9.152  -0.346   1.426  1.00  0.00           H  
HETATM   57  H   UNL     1       7.249  -1.899   1.590  1.00  0.00           H  
HETATM   58  H   UNL     1       4.135  -1.372  -1.581  1.00  0.00           H  
HETATM   59  H   UNL     1       5.134  -2.670  -2.279  1.00  0.00           H  
HETATM   60  H   UNL     1       2.841  -3.483  -2.008  1.00  0.00           H  
HETATM   61  H   UNL     1       3.897  -4.325  -0.849  1.00  0.00           H  
HETATM   62  H   UNL     1       0.917  -3.894  -0.553  1.00  0.00           H  
HETATM   63  H   UNL     1       1.974  -4.735   0.606  1.00  0.00           H  
HETATM   64  H   UNL     1       0.014  -3.869   1.791  1.00  0.00           H  
HETATM   65  H   UNL     1       1.453  -2.954   2.300  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.407  -1.970   2.391  1.00  0.00           H  
HETATM   67  H   UNL     1       0.032  -1.054   2.899  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.741   0.518   2.286  1.00  0.00           H  
HETATM   69  H   UNL     1      -0.440   0.608   1.075  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.343   1.332   0.626  1.00  0.00           H  
HETATM   71  H   UNL     1      -2.042   1.421  -0.586  1.00  0.00           H  
HETATM   72  H   UNL     1      -4.189   1.166  -1.734  1.00  0.00           H  
HETATM   73  H   UNL     1      -3.241  -0.328  -1.933  1.00  0.00           H  
HETATM   74  H   UNL     1      -6.255  -0.102  -2.063  1.00  0.00           H  
HETATM   75  H   UNL     1      -5.308  -1.595  -2.262  1.00  0.00           H  
HETATM   76  H   UNL     1      -7.562  -2.172  -1.500  1.00  0.00           H  
HETATM   77  H   UNL     1      -6.402  -2.507  -0.192  1.00  0.00           H  
HETATM   78  H   UNL     1      -9.349  -1.916   0.151  1.00  0.00           H  
HETATM   79  H   UNL     1      -8.189  -2.250   1.459  1.00  0.00           H  
HETATM   80  H   UNL     1     -10.048  -0.932   2.354  1.00  0.00           H  
HETATM   81  H   UNL     1      -8.579   0.073   2.332  1.00  0.00           H  
HETATM   82  H   UNL     1     -11.430   1.085   2.257  1.00  0.00           H  
HETATM   83  H   UNL     1      -9.961   2.090   2.235  1.00  0.00           H  
HETATM   84  H   UNL     1     -11.795   3.330   1.191  1.00  0.00           H  
HETATM   85  H   UNL     1     -10.604   2.894  -0.057  1.00  0.00           H  
HETATM   86  C   UNL     1     -13.058   2.624  -1.036  1.00  0.00           C  
HETATM   87  C   UNL     1     -14.116   1.783  -1.752  1.00  0.00           C  
HETATM   88  O   UNL     1     -15.108   1.365  -0.812  1.00  0.00           O  
HETATM   89  H   UNL     1     -13.542   3.453  -0.518  1.00  0.00           H  
HETATM   90  H   UNL     1     -12.350   3.016  -1.766  1.00  0.00           H  
HETATM   91  H   UNL     1     -14.585   2.378  -2.535  1.00  0.00           H  
HETATM   92  H   UNL     1     -13.644   0.906  -2.195  1.00  0.00           H  
HETATM   93  H   UNL     1     -15.813   0.826  -1.197  1.00  0.00           H  
CONECT    1    2   37   38   39                                       
CONECT    2    3    4    1    5                                       
CONECT    3    2   40   41   42                                       
CONECT    4    2   43   44   45                                       
CONECT    5    2    6   46   47                                       
CONECT    6    8    5    7    9                                       
CONECT    7    6   48   49   50                                       
CONECT    8    6   51   52   53                                       
CONECT    9    6   12   12   10                                       
CONECT   10    9   11   11   54                                       
CONECT   11   10   10   14   55                                       
CONECT   12    9    9   13   56                                       
CONECT   13   12   14   14   57                                       
CONECT   14   13   13   11   15                                       
CONECT   15   14   16                                                 
CONECT   16   15   17   58   59                                       
CONECT   17   16   18   60   61                                       
CONECT   18   17   19                                                 
CONECT   19   18   20   62   63                                       
CONECT   20   19   21   64   65                                       
CONECT   21   20   22                                                 
CONECT   22   21   23   66   67                                       
CONECT   23   22   24   68   69                                       
CONECT   24   23   25                                                 
CONECT   25   24   26   70   71                                       
CONECT   26   25   27   72   73                                       
CONECT   27   26   28                                                 
CONECT   28   29   27   74   75                                       
CONECT   29   28   30   76   77                                       
CONECT   30   29   31                                                 
CONECT   31   32   30   78   79                                       
CONECT   32   33   31   80   81                                       
CONECT   33   34   32                                                 
CONECT   34   35   33   82   83                                       
CONECT   35   36   34   84   85                                       
CONECT   36   35   86                                                 
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    3                                                      
CONECT   41    3                                                      
CONECT   42    3                                                      
CONECT   43    4                                                      
CONECT   44    4                                                      
CONECT   45    4                                                      
CONECT   46    5                                                      
CONECT   47    5                                                      
CONECT   48    7                                                      
CONECT   49    7                                                      
CONECT   50    7                                                      
CONECT   51    8                                                      
CONECT   52    8                                                      
CONECT   53    8                                                      
CONECT   54   10                                                      
CONECT   55   11                                                      
CONECT   56   12                                                      
CONECT   57   13                                                      
CONECT   58   16                                                      
CONECT   59   16                                                      
CONECT   60   17                                                      
CONECT   61   17                                                      
CONECT   62   19                                                      
CONECT   63   19                                                      
CONECT   64   20                                                      
CONECT   65   20                                                      
CONECT   66   22                                                      
CONECT   67   22                                                      
CONECT   68   23                                                      
CONECT   69   23                                                      
CONECT   70   25                                                      
CONECT   71   25                                                      
CONECT   72   26                                                      
CONECT   73   26                                                      
CONECT   74   28                                                      
CONECT   75   28                                                      
CONECT   76   29                                                      
CONECT   77   29                                                      
CONECT   78   31                                                      
CONECT   79   31                                                      
CONECT   80   32                                                      
CONECT   81   32                                                      
CONECT   82   34                                                      
CONECT   83   34                                                      
CONECT   84   35                                                      
CONECT   85   35                                                      
CONECT   86   36   87   89   90                                       
CONECT   87   86   88   91   92                                       
CONECT   88   87   93                                                 
CONECT   89   86                                                      
CONECT   90   86                                                      
CONECT   91   87                                                      
CONECT   92   87                                                      
CONECT   93   88                                                      
MASTER        0    0    0    0    0    0    0    0   93    0   93    0
END
