COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -7.066   3.388  10.234  1.00  0.00           N  
HETATM    2  C   UNL     1      -7.564  -0.504  14.301  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.782  -0.398  15.797  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.107   2.568   9.812  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.445  -1.357  13.820  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.267   3.116   8.862  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.920   1.196  10.345  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.045  -0.750  10.654  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.175  -0.565  11.448  1.00  0.00           C  
HETATM   10  O   UNL     1      -8.271   0.076  13.510  1.00  0.00           O  
HETATM   11  C   UNL     1      -6.842   4.463   9.465  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.636   5.706   9.624  1.00  0.00           C  
HETATM   13  C   UNL     1      -7.425   6.854   8.897  1.00  0.00           C  
HETATM   14  C   UNL     1      -8.942   7.067  10.460  1.00  0.00           C  
HETATM   15  C   UNL     1      -9.980   7.688  11.343  1.00  0.00           C  
HETATM   16  C   UNL     1     -10.603   7.004  12.334  1.00  0.00           C  
HETATM   17  C   UNL     1     -11.631   7.652  13.246  1.00  0.00           C  
HETATM   18  C   UNL     1     -11.132   7.594  14.703  1.00  0.00           C  
HETATM   19  C   UNL     1      -9.976   8.619  14.883  1.00  0.00           C  
HETATM   20  C   UNL     1      -8.890   8.183  15.857  1.00  0.00           C  
HETATM   21  C   UNL     1      -8.023   9.244  16.509  1.00  0.00           C  
HETATM   22  C   UNL     1      -8.647   5.762  16.677  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.891   4.561  16.220  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.137   8.936  17.687  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.741   9.536  17.702  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.049  10.993  18.011  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.885  11.759  18.593  1.00  0.00           C  
HETATM   28  C   UNL     1      -8.676   3.317  16.553  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.220  13.248  18.734  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.064  13.934  19.452  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.799  15.336  18.910  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.930  16.310  19.658  1.00  0.00           C  
HETATM   33  C   UNL     1      -1.595  15.652  19.361  1.00  0.00           C  
HETATM   34  C   UNL     1      -0.706  15.354  20.303  1.00  0.00           C  
HETATM   35  C   UNL     1      -5.145  -0.639  14.153  1.00  0.00           C  
HETATM   36  C   UNL     1     -10.432  10.057  15.096  1.00  0.00           C  
HETATM   37  C   UNL     1      -4.860   9.416  16.437  1.00  0.00           C  
HETATM   38  C   UNL     1      -4.126  13.781  20.983  1.00  0.00           C  
HETATM   39  C   UNL     1      -7.866   2.124  16.068  1.00  0.00           C  
HETATM   40  C   UNL     1      -2.999  17.739  19.136  1.00  0.00           C  
HETATM   41  C   UNL     1       1.154  14.483  21.102  1.00  0.00           C  
HETATM   42  C   UNL     1       0.800  14.377  18.734  1.00  0.00           C  
HETATM   43  C   UNL     1      -6.412  -3.526  10.855  1.00  0.00           C  
HETATM   44  C   UNL     1     -13.067   6.722  15.841  1.00  0.00           C  
HETATM   45  C   UNL     1      -6.961   7.767  19.851  1.00  0.00           C  
HETATM   46  C   UNL     1      -5.195  16.292  16.953  1.00  0.00           C  
HETATM   47  C   UNL     1      -6.133  17.085  17.769  1.00  0.00           C  
HETATM   48  C   UNL     1      -7.478  14.076  18.644  1.00  0.00           C  
HETATM   49  C   UNL     1      -8.591   0.808  16.249  1.00  0.00           C  
HETATM   50  C   UNL     1      -8.605  14.817  19.332  1.00  0.00           C  
HETATM   51  C   UNL     1      -9.721  13.819  19.539  1.00  0.00           C  
HETATM   52  C   UNL     1      -9.175  15.851  21.462  1.00  0.00           C  
HETATM   53  C   UNL     1     -10.362  11.992  18.190  1.00  0.00           C  
HETATM   54  C   UNL     1      -6.603  -1.681  12.321  1.00  0.00           C  
HETATM   55  N   UNL     1      -6.711   0.651  11.269  1.00  0.00           N  
HETATM   56  N   UNL     1      -8.531   5.815  10.617  1.00  0.00           N  
HETATM   57  N   UNL     1       0.410  14.760  20.085  1.00  0.00           N  
HETATM   58  O   UNL     1      -9.271   5.827  17.711  1.00  0.00           O  
HETATM   59  O   UNL     1     -12.176   7.826  15.670  1.00  0.00           O  
HETATM   60  O   UNL     1      -7.735   8.257  18.765  1.00  0.00           O  
HETATM   61  O   UNL     1      -6.443  13.442  19.445  1.00  0.00           O  
HETATM   62  O   UNL     1      -4.070  15.611  17.548  1.00  0.00           O  
HETATM   63  O   UNL     1       2.229  13.892  21.050  1.00  0.00           O  
HETATM   64  O   UNL     1      -5.290  16.200  15.725  1.00  0.00           O  
HETATM   65  O   UNL     1      -7.429  13.982  17.421  1.00  0.00           O  
HETATM   66  O   UNL     1      -8.160  15.364  20.569  1.00  0.00           O  
HETATM   67  O   UNL     1     -10.114  13.387  18.248  1.00  0.00           O  
HETATM   68  O   UNL     1      -8.540   6.826  15.747  1.00  0.00           O  
HETATM   69  O   UNL     1      -9.937   3.449  15.914  1.00  0.00           O  
HETATM   70  O   UNL     1      -5.851  -2.831  11.986  1.00  0.00           O  
HETATM   71  O   UNL     1      -4.890   0.409   9.959  1.00  0.00           O  
HETATM   72  O   UNL     1      -5.753   4.387   8.644  1.00  0.00           O  
HETATM   73  O   UNL     1      -8.316   7.751   9.448  1.00  0.00           O  
HETATM   74  S   UNL     1      -8.843   0.610  18.007  1.00  0.00           S  
HETATM   75  H   UNL     1      -8.308  -1.305  16.129  1.00  0.00           H  
HETATM   76  H   UNL     1      -6.796  -0.348  16.282  1.00  0.00           H  
HETATM   77  H   UNL     1      -6.464  -2.306  14.375  1.00  0.00           H  
HETATM   78  H   UNL     1      -4.414   2.649   8.392  1.00  0.00           H  
HETATM   79  H   UNL     1      -4.422  -1.630  10.601  1.00  0.00           H  
HETATM   80  H   UNL     1      -6.728   7.015   8.088  1.00  0.00           H  
HETATM   81  H   UNL     1     -10.243   8.723  11.184  1.00  0.00           H  
HETATM   82  H   UNL     1     -10.360   5.962  12.480  1.00  0.00           H  
HETATM   83  H   UNL     1     -11.775   8.701  12.949  1.00  0.00           H  
HETATM   84  H   UNL     1     -12.586   7.113  13.164  1.00  0.00           H  
HETATM   85  H   UNL     1     -10.711   6.591  14.870  1.00  0.00           H  
HETATM   86  H   UNL     1      -9.476   8.633  13.903  1.00  0.00           H  
HETATM   87  H   UNL     1      -9.565   8.057  16.716  1.00  0.00           H  
HETATM   88  H   UNL     1      -7.362   9.630  15.719  1.00  0.00           H  
HETATM   89  H   UNL     1      -8.706  10.041  16.837  1.00  0.00           H  
HETATM   90  H   UNL     1      -6.916   4.526  16.728  1.00  0.00           H  
HETATM   91  H   UNL     1      -7.736   4.617  15.132  1.00  0.00           H  
HETATM   92  H   UNL     1      -6.780   8.000  17.232  1.00  0.00           H  
HETATM   93  H   UNL     1      -5.186   9.109  18.550  1.00  0.00           H  
HETATM   94  H   UNL     1      -6.355  11.487  17.077  1.00  0.00           H  
HETATM   95  H   UNL     1      -6.879  11.025  18.732  1.00  0.00           H  
HETATM   96  H   UNL     1      -4.645  11.349  19.585  1.00  0.00           H  
HETATM   97  H   UNL     1      -4.014  11.648  17.930  1.00  0.00           H  
HETATM   98  H   UNL     1      -8.801   3.248  17.644  1.00  0.00           H  
HETATM   99  H   UNL     1      -5.306  13.679  17.726  1.00  0.00           H  
HETATM  100  H   UNL     1      -3.176  13.355  19.157  1.00  0.00           H  
HETATM  101  H   UNL     1      -4.745  15.755  19.282  1.00  0.00           H  
HETATM  102  H   UNL     1      -3.146  16.281  20.736  1.00  0.00           H  
HETATM  103  H   UNL     1      -1.356  15.415  18.335  1.00  0.00           H  
HETATM  104  H   UNL     1      -0.939  15.631  21.321  1.00  0.00           H  
HETATM  105  H   UNL     1      -5.101  -0.441  15.234  1.00  0.00           H  
HETATM  106  H   UNL     1      -4.293  -1.270  13.861  1.00  0.00           H  
HETATM  107  H   UNL     1      -5.101   0.313  13.604  1.00  0.00           H  
HETATM  108  H   UNL     1      -9.553  10.708  15.213  1.00  0.00           H  
HETATM  109  H   UNL     1     -11.020  10.388  14.227  1.00  0.00           H  
HETATM  110  H   UNL     1     -11.053  10.114  16.002  1.00  0.00           H  
HETATM  111  H   UNL     1      -3.889   9.900  16.618  1.00  0.00           H  
HETATM  112  H   UNL     1      -4.701   8.354  16.200  1.00  0.00           H  
HETATM  113  H   UNL     1      -5.363   9.909  15.592  1.00  0.00           H  
HETATM  114  H   UNL     1      -3.267  14.296  21.439  1.00  0.00           H  
HETATM  115  H   UNL     1      -5.060  14.224  21.358  1.00  0.00           H  
HETATM  116  H   UNL     1      -4.095  12.713  21.246  1.00  0.00           H  
HETATM  117  H   UNL     1      -6.923   2.086  16.634  1.00  0.00           H  
HETATM  118  H   UNL     1      -7.647   2.260  14.999  1.00  0.00           H  
HETATM  119  H   UNL     1      -2.338  18.381  19.736  1.00  0.00           H  
HETATM  120  H   UNL     1      -2.677  17.761  18.084  1.00  0.00           H  
HETATM  121  H   UNL     1      -4.033  18.107  19.210  1.00  0.00           H  
HETATM  122  H   UNL     1       0.804  14.795  22.075  1.00  0.00           H  
HETATM  123  H   UNL     1       1.783  13.884  18.761  1.00  0.00           H  
HETATM  124  H   UNL     1       0.054  13.683  18.320  1.00  0.00           H  
HETATM  125  H   UNL     1       0.858  15.275  18.101  1.00  0.00           H  
HETATM  126  H   UNL     1      -5.800  -4.411  10.627  1.00  0.00           H  
HETATM  127  H   UNL     1      -7.439  -3.841  11.091  1.00  0.00           H  
HETATM  128  H   UNL     1      -6.426  -2.856   9.983  1.00  0.00           H  
HETATM  129  H   UNL     1     -13.830   6.978  16.591  1.00  0.00           H  
HETATM  130  H   UNL     1     -13.557   6.495  14.883  1.00  0.00           H  
HETATM  131  H   UNL     1     -12.500   5.843  16.181  1.00  0.00           H  
HETATM  132  H   UNL     1      -7.621   7.273  20.579  1.00  0.00           H  
HETATM  133  H   UNL     1      -6.221   7.044  19.477  1.00  0.00           H  
HETATM  134  H   UNL     1      -6.441   8.605  20.338  1.00  0.00           H  
HETATM  135  H   UNL     1      -6.886  17.550  17.115  1.00  0.00           H  
HETATM  136  H   UNL     1      -6.633  16.427  18.495  1.00  0.00           H  
HETATM  137  H   UNL     1      -5.579  17.869  18.306  1.00  0.00           H  
HETATM  138  H   UNL     1      -9.579   0.827  15.766  1.00  0.00           H  
HETATM  139  H   UNL     1      -8.961  15.619  18.669  1.00  0.00           H  
HETATM  140  H   UNL     1     -10.567  14.296  20.055  1.00  0.00           H  
HETATM  141  H   UNL     1      -9.363  12.965  20.133  1.00  0.00           H  
HETATM  142  H   UNL     1      -8.703  16.245  22.374  1.00  0.00           H  
HETATM  143  H   UNL     1      -9.744  16.653  20.968  1.00  0.00           H  
HETATM  144  H   UNL     1      -9.856  15.028  21.727  1.00  0.00           H  
HETATM  145  H   UNL     1     -10.662  11.715  17.169  1.00  0.00           H  
HETATM  146  H   UNL     1      -9.448  11.446  18.465  1.00  0.00           H  
HETATM  147  H   UNL     1     -11.168  11.734  18.892  1.00  0.00           H  
HETATM  148  H   UNL     1      -7.669  -1.878  12.134  1.00  0.00           H  
HETATM  149  H   UNL     1     -10.390   4.209  16.260  1.00  0.00           H  
HETATM  150  H   UNL     1      -9.533   1.671  18.302  1.00  0.00           H  
CONECT    1   11   11    4                                            
CONECT    2   10   10    5    3                                       
CONECT    3    2   49   75   76                                       
CONECT    4    6    6    1    7                                       
CONECT    5   54   35    2   77                                       
CONECT    6   72    4    4   78                                       
CONECT    7    4   71   55   55                                       
CONECT    8   71    9    9   79                                       
CONECT    9    8    8   55   54                                       
CONECT   10    2    2                                                 
CONECT   11   72   12    1    1                                       
CONECT   12   13   13   11   56                                       
CONECT   13   73   12   12   80                                       
CONECT   14   73   56   56   15                                       
CONECT   15   14   16   16   81                                       
CONECT   16   15   15   17   82                                       
CONECT   17   16   18   83   84                                       
CONECT   18   17   19   59   85                                       
CONECT   19   18   36   20   86                                       
CONECT   20   19   68   21   87                                       
CONECT   21   20   24   88   89                                       
CONECT   22   68   23   58   58                                       
CONECT   23   28   22   90   91                                       
CONECT   24   21   25   60   92                                       
CONECT   25   37   24   26   93                                       
CONECT   26   25   27   94   95                                       
CONECT   27   26   29   96   97                                       
CONECT   28   69   39   23   98                                       
CONECT   29   27   61   30   99                                       
CONECT   30   29   31   38  100                                       
CONECT   31   62   30   32  101                                       
CONECT   32   31   40   33  102                                       
CONECT   33   32   34   34  103                                       
CONECT   34   33   33   57  104                                       
CONECT   35    5  105  106  107                                       
CONECT   36   19  108  109  110                                       
CONECT   37   25  111  112  113                                       
CONECT   38   30  114  115  116                                       
CONECT   39   49   28  117  118                                       
CONECT   40   32  119  120  121                                       
CONECT   41   57   63   63  122                                       
CONECT   42   57  123  124  125                                       
CONECT   43   70  126  127  128                                       
CONECT   44   59  129  130  131                                       
CONECT   45   60  132  133  134                                       
CONECT   46   64   64   62   47                                       
CONECT   47   46  135  136  137                                       
CONECT   48   65   65   50   61                                       
CONECT   49    3   39   74  138                                       
CONECT   50   48   51   66  139                                       
CONECT   51   67   50  140  141                                       
CONECT   52   66  142  143  144                                       
CONECT   53   67  145  146  147                                       
CONECT   54    9   70    5  148                                       
CONECT   55    7    7    9                                            
CONECT   56   12   14   14                                            
CONECT   57   42   34   41                                            
CONECT   58   22   22                                                 
CONECT   59   18   44                                                 
CONECT   60   24   45                                                 
CONECT   61   48   29                                                 
CONECT   62   46   31                                                 
CONECT   63   41   41                                                 
CONECT   64   46   46                                                 
CONECT   65   48   48                                                 
CONECT   66   50   52                                                 
CONECT   67   53   51                                                 
CONECT   68   20   22                                                 
CONECT   69   28  149                                                 
CONECT   70   43   54                                                 
CONECT   71    7    8                                                 
CONECT   72    6   11                                                 
CONECT   73   13   14                                                 
CONECT   74   49  150                                                 
CONECT   75    3                                                      
CONECT   76    3                                                      
CONECT   77    5                                                      
CONECT   78    6                                                      
CONECT   79    8                                                      
CONECT   80   13                                                      
CONECT   81   15                                                      
CONECT   82   16                                                      
CONECT   83   17                                                      
CONECT   84   17                                                      
CONECT   85   18                                                      
CONECT   86   19                                                      
CONECT   87   20                                                      
CONECT   88   21                                                      
CONECT   89   21                                                      
CONECT   90   23                                                      
CONECT   91   23                                                      
CONECT   92   24                                                      
CONECT   93   25                                                      
CONECT   94   26                                                      
CONECT   95   26                                                      
CONECT   96   27                                                      
CONECT   97   27                                                      
CONECT   98   28                                                      
CONECT   99   29                                                      
CONECT  100   30                                                      
CONECT  101   31                                                      
CONECT  102   32                                                      
CONECT  103   33                                                      
CONECT  104   34                                                      
CONECT  105   35                                                      
CONECT  106   35                                                      
CONECT  107   35                                                      
CONECT  108   36                                                      
CONECT  109   36                                                      
CONECT  110   36                                                      
CONECT  111   37                                                      
CONECT  112   37                                                      
CONECT  113   37                                                      
CONECT  114   38                                                      
CONECT  115   38                                                      
CONECT  116   38                                                      
CONECT  117   39                                                      
CONECT  118   39                                                      
CONECT  119   40                                                      
CONECT  120   40                                                      
CONECT  121   40                                                      
CONECT  122   41                                                      
CONECT  123   42                                                      
CONECT  124   42                                                      
CONECT  125   42                                                      
CONECT  126   43                                                      
CONECT  127   43                                                      
CONECT  128   43                                                      
CONECT  129   44                                                      
CONECT  130   44                                                      
CONECT  131   44                                                      
CONECT  132   45                                                      
CONECT  133   45                                                      
CONECT  134   45                                                      
CONECT  135   47                                                      
CONECT  136   47                                                      
CONECT  137   47                                                      
CONECT  138   49                                                      
CONECT  139   50                                                      
CONECT  140   51                                                      
CONECT  141   51                                                      
CONECT  142   52                                                      
CONECT  143   52                                                      
CONECT  144   52                                                      
CONECT  145   53                                                      
CONECT  146   53                                                      
CONECT  147   53                                                      
CONECT  148   54                                                      
CONECT  149   69                                                      
CONECT  150   74                                                      
MASTER        0    0    0    0    0    0    0    0  150    0  150    0
END
