COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.475  -5.422   1.517  1.00  0.00           C  
HETATM    2  C   UNL     1       0.699  -4.957   0.077  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.651  -4.808  -0.627  1.00  0.00           C  
HETATM    4  O   UNL     1      -1.503  -3.919   0.142  1.00  0.00           O  
HETATM    5  O   UNL     1      -3.085  -4.200  -1.376  1.00  0.00           O  
HETATM    6  C   UNL     1      -2.732  -3.682  -0.343  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.672  -2.769   0.402  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.996  -2.670  -0.359  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.951  -1.743   0.396  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.274  -1.644  -0.365  1.00  0.00           C  
HETATM   11  C   UNL     1      -8.229  -0.718   0.390  1.00  0.00           C  
HETATM   12  C   UNL     1      -9.552  -0.619  -0.371  1.00  0.00           C  
HETATM   13  C   UNL     1     -10.507   0.308   0.385  1.00  0.00           C  
HETATM   14  C   UNL     1     -11.831   0.407  -0.376  1.00  0.00           C  
HETATM   15  C   UNL     1     -12.785   1.334   0.379  1.00  0.00           C  
HETATM   16  C   UNL     1     -14.109   1.433  -0.382  1.00  0.00           C  
HETATM   17  C   UNL     1     -15.064   2.359   0.373  1.00  0.00           C  
HETATM   18  C   UNL     1     -16.387   2.458  -0.388  1.00  0.00           C  
HETATM   19  C   UNL     1     -17.342   3.385   0.368  1.00  0.00           C  
HETATM   20  C   UNL     1     -18.666   3.484  -0.393  1.00  0.00           C  
HETATM   21  C   UNL     1     -19.620   4.411   0.362  1.00  0.00           C  
HETATM   22  C   UNL     1     -20.944   4.510  -0.399  1.00  0.00           C  
HETATM   23  C   UNL     1     -21.898   5.436   0.357  1.00  0.00           C  
HETATM   24  O   UNL     1       1.385  -3.677   0.083  1.00  0.00           O  
HETATM   25  O   UNL     1       3.309  -4.764   0.049  1.00  0.00           O  
HETATM   26  C   UNL     1       2.727  -3.705   0.067  1.00  0.00           C  
HETATM   27  C   UNL     1       3.508  -2.416   0.072  1.00  0.00           C  
HETATM   28  C   UNL     1       5.006  -2.727   0.051  1.00  0.00           C  
HETATM   29  C   UNL     1       5.798  -1.419   0.055  1.00  0.00           C  
HETATM   30  C   UNL     1       7.296  -1.730   0.035  1.00  0.00           C  
HETATM   31  C   UNL     1       8.089  -0.421   0.039  1.00  0.00           C  
HETATM   32  C   UNL     1       9.587  -0.732   0.019  1.00  0.00           C  
HETATM   33  C   UNL     1      10.379   0.577   0.023  1.00  0.00           C  
HETATM   34  C   UNL     1      11.877   0.266   0.003  1.00  0.00           C  
HETATM   35  C   UNL     1      12.670   1.574   0.007  1.00  0.00           C  
HETATM   36  C   UNL     1      14.168   1.264  -0.013  1.00  0.00           C  
HETATM   37  C   UNL     1      14.960   2.572  -0.009  1.00  0.00           C  
HETATM   38  C   UNL     1      16.458   2.261  -0.029  1.00  0.00           C  
HETATM   39  C   UNL     1      17.251   3.570  -0.025  1.00  0.00           C  
HETATM   40  C   UNL     1      18.749   3.259  -0.045  1.00  0.00           C  
HETATM   41  C   UNL     1      19.542   4.568  -0.041  1.00  0.00           C  
HETATM   42  C   UNL     1      21.039   4.257  -0.061  1.00  0.00           C  
HETATM   43  C   UNL     1      21.832   5.565  -0.057  1.00  0.00           C  
HETATM   44  H   UNL     1      -0.132  -4.687   2.046  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.041  -6.382   1.513  1.00  0.00           H  
HETATM   46  H   UNL     1       1.436  -5.528   2.019  1.00  0.00           H  
HETATM   47  H   UNL     1       1.305  -5.692  -0.452  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.498  -4.393  -1.623  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.127  -5.786  -0.710  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.856  -3.171   1.398  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.227  -1.778   0.485  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.813  -2.269  -1.356  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.442  -3.661  -0.443  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.134  -2.145   1.393  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.505  -0.752   0.480  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.091  -1.243  -1.362  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.720  -2.635  -0.449  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.412  -1.119   1.387  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.783   0.273   0.474  1.00  0.00           H  
HETATM   60  H   UNL     1      -9.369  -0.217  -1.367  1.00  0.00           H  
HETATM   61  H   UNL     1      -9.998  -1.610  -0.454  1.00  0.00           H  
HETATM   62  H   UNL     1     -10.690  -0.094   1.382  1.00  0.00           H  
HETATM   63  H   UNL     1     -10.061   1.299   0.468  1.00  0.00           H  
HETATM   64  H   UNL     1     -11.648   0.808  -1.373  1.00  0.00           H  
HETATM   65  H   UNL     1     -12.277  -0.584  -0.460  1.00  0.00           H  
HETATM   66  H   UNL     1     -12.969   0.932   1.376  1.00  0.00           H  
HETATM   67  H   UNL     1     -12.340   2.325   0.463  1.00  0.00           H  
HETATM   68  H   UNL     1     -13.926   1.834  -1.379  1.00  0.00           H  
HETATM   69  H   UNL     1     -14.555   0.442  -0.466  1.00  0.00           H  
HETATM   70  H   UNL     1     -15.247   1.958   1.370  1.00  0.00           H  
HETATM   71  H   UNL     1     -14.618   3.350   0.457  1.00  0.00           H  
HETATM   72  H   UNL     1     -16.204   2.860  -1.384  1.00  0.00           H  
HETATM   73  H   UNL     1     -16.833   1.467  -0.471  1.00  0.00           H  
HETATM   74  H   UNL     1     -17.525   2.984   1.365  1.00  0.00           H  
HETATM   75  H   UNL     1     -16.896   4.376   0.452  1.00  0.00           H  
HETATM   76  H   UNL     1     -18.482   3.885  -1.390  1.00  0.00           H  
HETATM   77  H   UNL     1     -19.111   2.493  -0.477  1.00  0.00           H  
HETATM   78  H   UNL     1     -19.803   4.009   1.359  1.00  0.00           H  
HETATM   79  H   UNL     1     -19.174   5.402   0.446  1.00  0.00           H  
HETATM   80  H   UNL     1     -20.760   4.911  -1.395  1.00  0.00           H  
HETATM   81  H   UNL     1     -21.390   3.519  -0.483  1.00  0.00           H  
HETATM   82  H   UNL     1     -22.841   5.507  -0.185  1.00  0.00           H  
HETATM   83  H   UNL     1     -22.082   5.035   1.353  1.00  0.00           H  
HETATM   84  H   UNL     1     -21.452   6.427   0.440  1.00  0.00           H  
HETATM   85  H   UNL     1       3.246  -1.830  -0.809  1.00  0.00           H  
HETATM   86  H   UNL     1       3.267  -1.849   0.970  1.00  0.00           H  
HETATM   87  H   UNL     1       5.267  -3.314   0.932  1.00  0.00           H  
HETATM   88  H   UNL     1       5.247  -3.295  -0.848  1.00  0.00           H  
HETATM   89  H   UNL     1       5.537  -0.832  -0.825  1.00  0.00           H  
HETATM   90  H   UNL     1       5.557  -0.851   0.954  1.00  0.00           H  
HETATM   91  H   UNL     1       7.558  -2.316   0.915  1.00  0.00           H  
HETATM   92  H   UNL     1       7.537  -2.297  -0.864  1.00  0.00           H  
HETATM   93  H   UNL     1       7.827   0.166  -0.841  1.00  0.00           H  
HETATM   94  H   UNL     1       7.848   0.147   0.938  1.00  0.00           H  
HETATM   95  H   UNL     1       9.848  -1.318   0.900  1.00  0.00           H  
HETATM   96  H   UNL     1       9.828  -1.299  -0.880  1.00  0.00           H  
HETATM   97  H   UNL     1      10.118   1.163  -0.857  1.00  0.00           H  
HETATM   98  H   UNL     1      10.139   1.144   0.922  1.00  0.00           H  
HETATM   99  H   UNL     1      12.139  -0.321   0.883  1.00  0.00           H  
HETATM  100  H   UNL     1      12.118  -0.302  -0.896  1.00  0.00           H  
HETATM  101  H   UNL     1      12.408   2.161  -0.873  1.00  0.00           H  
HETATM  102  H   UNL     1      12.429   2.142   0.906  1.00  0.00           H  
HETATM  103  H   UNL     1      14.429   0.677   0.868  1.00  0.00           H  
HETATM  104  H   UNL     1      14.409   0.696  -0.912  1.00  0.00           H  
HETATM  105  H   UNL     1      14.699   3.159  -0.889  1.00  0.00           H  
HETATM  106  H   UNL     1      14.720   3.140   0.890  1.00  0.00           H  
HETATM  107  H   UNL     1      16.720   1.675   0.851  1.00  0.00           H  
HETATM  108  H   UNL     1      16.699   1.694  -0.928  1.00  0.00           H  
HETATM  109  H   UNL     1      16.990   4.156  -0.905  1.00  0.00           H  
HETATM  110  H   UNL     1      17.010   4.137   0.874  1.00  0.00           H  
HETATM  111  H   UNL     1      19.010   2.673   0.835  1.00  0.00           H  
HETATM  112  H   UNL     1      18.990   2.692  -0.944  1.00  0.00           H  
HETATM  113  H   UNL     1      19.280   5.154  -0.921  1.00  0.00           H  
HETATM  114  H   UNL     1      19.301   5.135   0.858  1.00  0.00           H  
HETATM  115  H   UNL     1      21.301   3.670   0.819  1.00  0.00           H  
HETATM  116  H   UNL     1      21.280   3.689  -0.960  1.00  0.00           H  
HETATM  117  H   UNL     1      22.899   5.344  -0.071  1.00  0.00           H  
HETATM  118  H   UNL     1      21.571   6.152  -0.938  1.00  0.00           H  
HETATM  119  H   UNL     1      21.591   6.133   0.842  1.00  0.00           H  
CONECT    1    2   44   45   46                                       
CONECT    2    1   24    3   47                                       
CONECT    3    2    4   48   49                                       
CONECT    4    3    6                                                 
CONECT    5    6    6                                                 
CONECT    6    5    5    4    7                                       
CONECT    7    6    8   50   51                                       
CONECT    8    7    9   52   53                                       
CONECT    9    8   10   54   55                                       
CONECT   10    9   11   56   57                                       
CONECT   11   10   12   58   59                                       
CONECT   12   11   13   60   61                                       
CONECT   13   12   14   62   63                                       
CONECT   14   15   13   64   65                                       
CONECT   15   16   14   66   67                                       
CONECT   16   17   15   68   69                                       
CONECT   17   18   16   70   71                                       
CONECT   18   19   17   72   73                                       
CONECT   19   20   18   74   75                                       
CONECT   20   21   19   76   77                                       
CONECT   21   22   20   78   79                                       
CONECT   22   23   21   80   81                                       
CONECT   23   22   82   83   84                                       
CONECT   24    2   26                                                 
CONECT   25   26   26                                                 
CONECT   26   24   27   25   25                                       
CONECT   27   28   26   85   86                                       
CONECT   28   29   27   87   88                                       
CONECT   29   28   30   89   90                                       
CONECT   30   31   29   91   92                                       
CONECT   31   32   30   93   94                                       
CONECT   32   33   31   95   96                                       
CONECT   33   34   32   97   98                                       
CONECT   34   33   35   99  100                                       
CONECT   35   36   34  101  102                                       
CONECT   36   37   35  103  104                                       
CONECT   37   38   36  105  106                                       
CONECT   38   39   37  107  108                                       
CONECT   39   38   40  109  110                                       
CONECT   40   39   41  111  112                                       
CONECT   41   42   40  113  114                                       
CONECT   42   43   41  115  116                                       
CONECT   43   42  117  118  119                                       
CONECT   44    1                                                      
CONECT   45    1                                                      
CONECT   46    1                                                      
CONECT   47    2                                                      
CONECT   48    3                                                      
CONECT   49    3                                                      
CONECT   50    7                                                      
CONECT   51    7                                                      
CONECT   52    8                                                      
CONECT   53    8                                                      
CONECT   54    9                                                      
CONECT   55    9                                                      
CONECT   56   10                                                      
CONECT   57   10                                                      
CONECT   58   11                                                      
CONECT   59   11                                                      
CONECT   60   12                                                      
CONECT   61   12                                                      
CONECT   62   13                                                      
CONECT   63   13                                                      
CONECT   64   14                                                      
CONECT   65   14                                                      
CONECT   66   15                                                      
CONECT   67   15                                                      
CONECT   68   16                                                      
CONECT   69   16                                                      
CONECT   70   17                                                      
CONECT   71   17                                                      
CONECT   72   18                                                      
CONECT   73   18                                                      
CONECT   74   19                                                      
CONECT   75   19                                                      
CONECT   76   20                                                      
CONECT   77   20                                                      
CONECT   78   21                                                      
CONECT   79   21                                                      
CONECT   80   22                                                      
CONECT   81   22                                                      
CONECT   82   23                                                      
CONECT   83   23                                                      
CONECT   84   23                                                      
CONECT   85   27                                                      
CONECT   86   27                                                      
CONECT   87   28                                                      
CONECT   88   28                                                      
CONECT   89   29                                                      
CONECT   90   29                                                      
CONECT   91   30                                                      
CONECT   92   30                                                      
CONECT   93   31                                                      
CONECT   94   31                                                      
CONECT   95   32                                                      
CONECT   96   32                                                      
CONECT   97   33                                                      
CONECT   98   33                                                      
CONECT   99   34                                                      
CONECT  100   34                                                      
CONECT  101   35                                                      
CONECT  102   35                                                      
CONECT  103   36                                                      
CONECT  104   36                                                      
CONECT  105   37                                                      
CONECT  106   37                                                      
CONECT  107   38                                                      
CONECT  108   38                                                      
CONECT  109   39                                                      
CONECT  110   39                                                      
CONECT  111   40                                                      
CONECT  112   40                                                      
CONECT  113   41                                                      
CONECT  114   41                                                      
CONECT  115   42                                                      
CONECT  116   42                                                      
CONECT  117   43                                                      
CONECT  118   43                                                      
CONECT  119   43                                                      
MASTER        0    0    0    0    0    0    0    0  119    0  119    0
END
