COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.526  -1.454   1.003  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.922   2.237   1.679  1.00  0.00           C  
HETATM    3  C   UNL     1       6.600  -1.047  -0.147  1.00  0.00           C  
HETATM    4  C   UNL     1       6.440   0.474  -0.161  1.00  0.00           C  
HETATM    5  C   UNL     1       2.264   2.316   0.397  1.00  0.00           C  
HETATM    6  C   UNL     1       5.611   0.889  -1.378  1.00  0.00           C  
HETATM    7  C   UNL     1       5.349   2.372  -1.326  1.00  0.00           C  
HETATM    8  C   UNL     1       4.128   2.816  -1.160  1.00  0.00           C  
HETATM    9  C   UNL     1       3.011   1.852  -0.855  1.00  0.00           C  
HETATM   10  C   UNL     1       1.130   1.337   0.707  1.00  0.00           C  
HETATM   11  C   UNL     1       0.319   1.858   1.865  1.00  0.00           C  
HETATM   12  C   UNL     1       7.642  -2.981   1.045  1.00  0.00           C  
HETATM   13  C   UNL     1       5.314  -3.009   0.218  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.562   2.079   0.324  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.330   0.756   0.274  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.093   0.659  -1.048  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.945  -0.612  -1.053  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.052  -0.488  -0.004  1.00  0.00           C  
HETATM   19  C   UNL     1       6.247  -3.580   1.263  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.818  -1.809   0.087  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.908  -1.687   1.120  1.00  0.00           C  
HETATM   22  C   UNL     1      -8.162  -1.833   0.770  1.00  0.00           C  
HETATM   23  C   UNL     1      -8.506  -2.290  -0.624  1.00  0.00           C  
HETATM   24  C   UNL     1      -9.450  -3.492  -0.548  1.00  0.00           C  
HETATM   25  C   UNL     1       8.911  -0.843   0.784  1.00  0.00           C  
HETATM   26  C   UNL     1       2.042   1.804  -2.038  1.00  0.00           C  
HETATM   27  C   UNL     1       1.718  -0.028   1.069  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.707   2.831   2.819  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.345  -0.410   0.382  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.572  -0.800  -2.436  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.856  -2.929   0.491  1.00  0.00           C  
HETATM   32  C   UNL     1      -5.815   1.761   0.231  1.00  0.00           C  
HETATM   33  N   UNL     1      -6.576   2.812  -0.133  1.00  0.00           N  
HETATM   34  O   UNL     1       4.602  -3.730  -0.440  1.00  0.00           O  
HETATM   35  O   UNL     1       3.169   2.361   1.502  1.00  0.00           O  
HETATM   36  O   UNL     1      -2.163   0.613  -2.132  1.00  0.00           O  
HETATM   37  O   UNL     1      -5.964   0.575  -0.387  1.00  0.00           O  
HETATM   38  O   UNL     1      -4.994   1.885   1.118  1.00  0.00           O  
HETATM   39  O   UNL     1       5.300  -1.672   0.042  1.00  0.00           O  
HETATM   40  O   UNL     1       6.329   0.574  -2.573  1.00  0.00           O  
HETATM   41  H   UNL     1       7.114  -1.094   1.946  1.00  0.00           H  
HETATM   42  H   UNL     1       7.029  -1.378  -1.094  1.00  0.00           H  
HETATM   43  H   UNL     1       5.933   0.794   0.750  1.00  0.00           H  
HETATM   44  H   UNL     1       7.423   0.943  -0.213  1.00  0.00           H  
HETATM   45  H   UNL     1       1.850   3.310   0.226  1.00  0.00           H  
HETATM   46  H   UNL     1       4.663   0.352  -1.372  1.00  0.00           H  
HETATM   47  H   UNL     1       6.168   3.069  -1.425  1.00  0.00           H  
HETATM   48  H   UNL     1       3.922   3.873  -1.241  1.00  0.00           H  
HETATM   49  H   UNL     1       3.425   0.859  -0.683  1.00  0.00           H  
HETATM   50  H   UNL     1       0.489   1.235  -0.169  1.00  0.00           H  
HETATM   51  H   UNL     1       0.760   1.919   2.849  1.00  0.00           H  
HETATM   52  H   UNL     1       8.051  -3.342   0.102  1.00  0.00           H  
HETATM   53  H   UNL     1       8.297  -3.274   1.866  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.251   2.905   0.149  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.790   2.080  -0.445  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.035   0.714   1.105  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.739   1.530  -1.160  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.317  -1.471  -0.819  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.610  -0.256   0.965  1.00  0.00           H  
HETATM   60  H   UNL     1       6.294  -4.665   1.160  1.00  0.00           H  
HETATM   61  H   UNL     1       5.887  -3.321   2.258  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.260  -2.041  -0.882  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.656  -1.479   2.150  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.949  -1.626   1.480  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.995  -1.478  -1.162  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.594  -2.576  -1.148  1.00  0.00           H  
HETATM   67  H   UNL     1      -8.961  -4.304  -0.010  1.00  0.00           H  
HETATM   68  H   UNL     1     -10.361  -3.206  -0.024  1.00  0.00           H  
HETATM   69  H   UNL     1      -9.698  -3.823  -1.557  1.00  0.00           H  
HETATM   70  H   UNL     1       9.322  -1.203  -0.159  1.00  0.00           H  
HETATM   71  H   UNL     1       8.829   0.243   0.754  1.00  0.00           H  
HETATM   72  H   UNL     1       9.570  -1.135   1.602  1.00  0.00           H  
HETATM   73  H   UNL     1       1.628   2.797  -2.209  1.00  0.00           H  
HETATM   74  H   UNL     1       2.574   1.473  -2.930  1.00  0.00           H  
HETATM   75  H   UNL     1       1.234   1.106  -1.817  1.00  0.00           H  
HETATM   76  H   UNL     1       0.911  -0.745   1.213  1.00  0.00           H  
HETATM   77  H   UNL     1       2.368  -0.368   0.263  1.00  0.00           H  
HETATM   78  H   UNL     1       2.296   0.059   1.990  1.00  0.00           H  
HETATM   79  H   UNL     1      -2.223   2.036   3.358  1.00  0.00           H  
HETATM   80  H   UNL     1      -1.029   3.348   3.497  1.00  0.00           H  
HETATM   81  H   UNL     1      -2.439   3.537   2.427  1.00  0.00           H  
HETATM   82  H   UNL     1      -0.866  -0.392   1.361  1.00  0.00           H  
HETATM   83  H   UNL     1      -1.881  -1.351   0.257  1.00  0.00           H  
HETATM   84  H   UNL     1      -0.587  -0.318  -0.396  1.00  0.00           H  
HETATM   85  H   UNL     1      -3.787  -0.800  -3.194  1.00  0.00           H  
HETATM   86  H   UNL     1      -5.106  -1.750  -2.467  1.00  0.00           H  
HETATM   87  H   UNL     1      -5.268   0.015  -2.634  1.00  0.00           H  
HETATM   88  H   UNL     1      -5.402  -3.870   0.556  1.00  0.00           H  
HETATM   89  H   UNL     1      -4.068  -3.017  -0.257  1.00  0.00           H  
HETATM   90  H   UNL     1      -4.414  -2.697   1.460  1.00  0.00           H  
HETATM   91  H   UNL     1      -6.468   3.667   0.312  1.00  0.00           H  
HETATM   92  H   UNL     1      -7.231   2.714  -0.841  1.00  0.00           H  
HETATM   93  H   UNL     1       3.576   1.510   1.712  1.00  0.00           H  
HETATM   94  H   UNL     1      -1.555  -0.138  -2.098  1.00  0.00           H  
HETATM   95  H   UNL     1       7.149   1.075  -2.682  1.00  0.00           H  
CONECT    1    3   25   12   41                                       
CONECT    2   11   11   14   28                                       
CONECT    3    4   39    1   42                                       
CONECT    4    6    3   43   44                                       
CONECT    5   35    9   10   45                                       
CONECT    6   40    7    4   46                                       
CONECT    7    8    8    6   47                                       
CONECT    8    9    7    7   48                                       
CONECT    9   26    8    5   49                                       
CONECT   10    5   27   11   50                                       
CONECT   11   10    2    2   51                                       
CONECT   12    1   19   52   53                                       
CONECT   13   39   34   34   19                                       
CONECT   14    2   15   54   55                                       
CONECT   15   14   29   16   56                                       
CONECT   16   15   17   36   57                                       
CONECT   17   16   18   30   58                                       
CONECT   18   20   37   17   59                                       
CONECT   19   12   13   60   61                                       
CONECT   20   21   31   18   62                                       
CONECT   21   22   22   20   63                                       
CONECT   22   23   21   21   64                                       
CONECT   23   24   22   65   66                                       
CONECT   24   23   67   68   69                                       
CONECT   25    1   70   71   72                                       
CONECT   26    9   73   74   75                                       
CONECT   27   10   76   77   78                                       
CONECT   28    2   79   80   81                                       
CONECT   29   15   82   83   84                                       
CONECT   30   17   85   86   87                                       
CONECT   31   20   88   89   90                                       
CONECT   32   37   33   38   38                                       
CONECT   33   32   91   92                                            
CONECT   34   13   13                                                 
CONECT   35    5   93                                                 
CONECT   36   16   94                                                 
CONECT   37   18   32                                                 
CONECT   38   32   32                                                 
CONECT   39    3   13                                                 
CONECT   40    6   95                                                 
CONECT   41    1                                                      
CONECT   42    3                                                      
CONECT   43    4                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
CONECT   48    8                                                      
CONECT   49    9                                                      
CONECT   50   10                                                      
CONECT   51   11                                                      
CONECT   52   12                                                      
CONECT   53   12                                                      
CONECT   54   14                                                      
CONECT   55   14                                                      
CONECT   56   15                                                      
CONECT   57   16                                                      
CONECT   58   17                                                      
CONECT   59   18                                                      
CONECT   60   19                                                      
CONECT   61   19                                                      
CONECT   62   20                                                      
CONECT   63   21                                                      
CONECT   64   22                                                      
CONECT   65   23                                                      
CONECT   66   23                                                      
CONECT   67   24                                                      
CONECT   68   24                                                      
CONECT   69   24                                                      
CONECT   70   25                                                      
CONECT   71   25                                                      
CONECT   72   25                                                      
CONECT   73   26                                                      
CONECT   74   26                                                      
CONECT   75   26                                                      
CONECT   76   27                                                      
CONECT   77   27                                                      
CONECT   78   27                                                      
CONECT   79   28                                                      
CONECT   80   28                                                      
CONECT   81   28                                                      
CONECT   82   29                                                      
CONECT   83   29                                                      
CONECT   84   29                                                      
CONECT   85   30                                                      
CONECT   86   30                                                      
CONECT   87   30                                                      
CONECT   88   31                                                      
CONECT   89   31                                                      
CONECT   90   31                                                      
CONECT   91   33                                                      
CONECT   92   33                                                      
CONECT   93   35                                                      
CONECT   94   36                                                      
CONECT   95   40                                                      
MASTER        0    0    0    0    0    0    0    0   95    0   95    0
END
