COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.645   2.378  -0.285  1.00  0.00           C  
HETATM    2  C   UNL     1       6.351   2.033   0.458  1.00  0.00           C  
HETATM    3  C   UNL     1       5.558   3.315   0.721  1.00  0.00           C  
HETATM    4  C   UNL     1       8.462   1.099  -0.492  1.00  0.00           C  
HETATM    5 CL   UNL     1     -11.735   3.318   0.551  1.00  0.00          Cl  
HETATM    6  C   UNL     1     -11.745   1.650   0.069  1.00  0.00           C  
HETATM    7  C   UNL     1     -12.819   0.955  -0.500  1.00  0.00           C  
HETATM    8 CL   UNL     1     -14.387   1.609  -0.853  1.00  0.00          Cl  
HETATM    9  C   UNL     1     -12.416  -0.318  -0.726  1.00  0.00           C  
HETATM   10  C   UNL     1     -13.262  -1.410  -1.331  1.00  0.00           C  
HETATM   11  N   UNL     1     -11.129  -0.451  -0.321  1.00  0.00           N  
HETATM   12  C   UNL     1     -10.694   0.761   0.170  1.00  0.00           C  
HETATM   13  C   UNL     1      -9.361   1.052   0.704  1.00  0.00           C  
HETATM   14  O   UNL     1      -9.099   2.168   1.113  1.00  0.00           O  
HETATM   15  N   UNL     1      -8.425   0.083   0.743  1.00  0.00           N  
HETATM   16  C   UNL     1      -7.092   0.374   1.277  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.107   0.216   2.798  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.077  -0.599   0.673  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.682  -0.294   1.227  1.00  0.00           C  
HETATM   20  O   UNL     1      -6.442  -1.940   1.009  1.00  0.00           O  
HETATM   21  C   UNL     1      -6.057  -0.440  -0.850  1.00  0.00           C  
HETATM   22  O   UNL     1      -7.335  -0.794  -1.384  1.00  0.00           O  
HETATM   23  C   UNL     1      -4.985  -1.360  -1.438  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.918  -1.163  -2.954  1.00  0.00           C  
HETATM   25  O   UNL     1      -3.717  -1.043  -0.860  1.00  0.00           O  
HETATM   26  C   UNL     1      -3.662  -1.220   0.559  1.00  0.00           C  
HETATM   27  O   UNL     1      -2.351  -0.903   1.030  1.00  0.00           O  
HETATM   28  C   UNL     1      -1.333  -1.786   0.553  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.172  -2.958   1.527  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.113  -3.936   1.013  1.00  0.00           C  
HETATM   31  C   UNL     1       1.165  -3.178   0.707  1.00  0.00           C  
HETATM   32  C   UNL     1       2.322  -3.569   1.181  1.00  0.00           C  
HETATM   33  C   UNL     1       1.044  -1.955  -0.167  1.00  0.00           C  
HETATM   34  C   UNL     1      -0.011  -1.036   0.459  1.00  0.00           C  
HETATM   35  C   UNL     1      -0.106   0.227  -0.335  1.00  0.00           C  
HETATM   36  C   UNL     1       0.867   0.651  -1.086  1.00  0.00           C  
HETATM   37  C   UNL     1       2.175  -0.056  -1.276  1.00  0.00           C  
HETATM   38  C   UNL     1       2.222  -0.654  -2.683  1.00  0.00           C  
HETATM   39  C   UNL     1       2.359  -1.183  -0.255  1.00  0.00           C  
HETATM   40  C   UNL     1       3.473  -2.096  -0.699  1.00  0.00           C  
HETATM   41  O   UNL     1       3.228  -3.053  -1.405  1.00  0.00           O  
HETATM   42  C   UNL     1       4.847  -1.829  -0.280  1.00  0.00           C  
HETATM   43  C   UNL     1       5.278  -0.716   0.574  1.00  0.00           C  
HETATM   44  O   UNL     1       4.538   0.131   1.038  1.00  0.00           O  
HETATM   45  C   UNL     1       5.950  -2.586  -0.617  1.00  0.00           C  
HETATM   46  O   UNL     1       5.966  -3.689  -1.381  1.00  0.00           O  
HETATM   47  C   UNL     1       7.137  -1.926   0.045  1.00  0.00           C  
HETATM   48  C   UNL     1       7.800  -2.895   1.026  1.00  0.00           C  
HETATM   49  C   UNL     1       6.750  -3.427   2.004  1.00  0.00           C  
HETATM   50  C   UNL     1       8.415  -4.062   0.253  1.00  0.00           C  
HETATM   51  N   UNL     1       6.607  -0.766   0.770  1.00  0.00           N  
HETATM   52  C   UNL     1       7.392   0.180   1.568  1.00  0.00           C  
HETATM   53  C   UNL     1       8.728   0.450   0.870  1.00  0.00           C  
HETATM   54  O   UNL     1       9.516   1.330   1.673  1.00  0.00           O  
HETATM   55  C   UNL     1      10.925   1.144   1.527  1.00  0.00           C  
HETATM   56  O   UNL     1       6.669   1.405   1.701  1.00  0.00           O  
HETATM   57  O   UNL     1       8.417   3.325   0.500  1.00  0.00           O  
HETATM   58  C   UNL     1       8.185   4.633   0.281  1.00  0.00           C  
HETATM   59  O   UNL     1       7.360   4.974  -0.543  1.00  0.00           O  
HETATM   60  N   UNL     1       8.868   5.564   0.976  1.00  0.00           N  
HETATM   61  O   UNL     1       9.724   1.426  -1.129  1.00  0.00           O  
HETATM   62  C   UNL     1       9.751   1.416  -2.471  1.00  0.00           C  
HETATM   63  O   UNL     1       8.752   1.143  -3.093  1.00  0.00           O  
HETATM   64  C   UNL     1      11.027   1.746  -3.202  1.00  0.00           C  
HETATM   65  H   UNL     1       7.404   2.817  -1.253  1.00  0.00           H  
HETATM   66  H   UNL     1       5.753   1.354  -0.150  1.00  0.00           H  
HETATM   67  H   UNL     1       5.316   3.794  -0.227  1.00  0.00           H  
HETATM   68  H   UNL     1       4.636   3.069   1.250  1.00  0.00           H  
HETATM   69  H   UNL     1       6.155   3.993   1.329  1.00  0.00           H  
HETATM   70  H   UNL     1       7.903   0.408  -1.123  1.00  0.00           H  
HETATM   71  H   UNL     1     -13.142  -1.403  -2.414  1.00  0.00           H  
HETATM   72  H   UNL     1     -12.945  -2.375  -0.936  1.00  0.00           H  
HETATM   73  H   UNL     1     -14.309  -1.240  -1.080  1.00  0.00           H  
HETATM   74  H   UNL     1     -10.601  -1.263  -0.372  1.00  0.00           H  
HETATM   75  H   UNL     1      -8.633  -0.806   0.416  1.00  0.00           H  
HETATM   76  H   UNL     1      -6.812   1.396   1.020  1.00  0.00           H  
HETATM   77  H   UNL     1      -6.115   0.433   3.196  1.00  0.00           H  
HETATM   78  H   UNL     1      -7.830   0.910   3.228  1.00  0.00           H  
HETATM   79  H   UNL     1      -7.386  -0.805   3.055  1.00  0.00           H  
HETATM   80  H   UNL     1      -4.425   0.744   1.015  1.00  0.00           H  
HETATM   81  H   UNL     1      -4.674  -0.460   2.305  1.00  0.00           H  
HETATM   82  H   UNL     1      -6.472  -2.113   1.960  1.00  0.00           H  
HETATM   83  H   UNL     1      -5.829   0.595  -1.105  1.00  0.00           H  
HETATM   84  H   UNL     1      -7.395  -0.716  -2.346  1.00  0.00           H  
HETATM   85  H   UNL     1      -5.235  -2.398  -1.217  1.00  0.00           H  
HETATM   86  H   UNL     1      -4.667  -0.125  -3.174  1.00  0.00           H  
HETATM   87  H   UNL     1      -4.154  -1.818  -3.372  1.00  0.00           H  
HETATM   88  H   UNL     1      -5.885  -1.404  -3.395  1.00  0.00           H  
HETATM   89  H   UNL     1      -3.896  -2.256   0.805  1.00  0.00           H  
HETATM   90  H   UNL     1      -1.610  -2.164  -0.431  1.00  0.00           H  
HETATM   91  H   UNL     1      -0.868  -2.577   2.502  1.00  0.00           H  
HETATM   92  H   UNL     1      -2.125  -3.477   1.627  1.00  0.00           H  
HETATM   93  H   UNL     1       0.085  -4.691   1.774  1.00  0.00           H  
HETATM   94  H   UNL     1      -0.475  -4.420   0.106  1.00  0.00           H  
HETATM   95  H   UNL     1       3.196  -2.948   1.053  1.00  0.00           H  
HETATM   96  H   UNL     1       0.725  -2.250  -1.166  1.00  0.00           H  
HETATM   97  H   UNL     1       0.308  -0.784   1.471  1.00  0.00           H  
HETATM   98  H   UNL     1      -1.015   0.808  -0.284  1.00  0.00           H  
HETATM   99  H   UNL     1       0.722   1.582  -1.613  1.00  0.00           H  
HETATM  100  H   UNL     1       2.988   0.662  -1.166  1.00  0.00           H  
HETATM  101  H   UNL     1       2.126   0.143  -3.420  1.00  0.00           H  
HETATM  102  H   UNL     1       3.172  -1.170  -2.827  1.00  0.00           H  
HETATM  103  H   UNL     1       1.403  -1.362  -2.804  1.00  0.00           H  
HETATM  104  H   UNL     1       2.594  -0.762   0.722  1.00  0.00           H  
HETATM  105  H   UNL     1       5.118  -3.990  -1.735  1.00  0.00           H  
HETATM  106  H   UNL     1       7.857  -1.606  -0.709  1.00  0.00           H  
HETATM  107  H   UNL     1       8.581  -2.374   1.580  1.00  0.00           H  
HETATM  108  H   UNL     1       5.969  -3.948   1.450  1.00  0.00           H  
HETATM  109  H   UNL     1       7.222  -4.117   2.703  1.00  0.00           H  
HETATM  110  H   UNL     1       6.311  -2.595   2.555  1.00  0.00           H  
HETATM  111  H   UNL     1       9.163  -3.683  -0.443  1.00  0.00           H  
HETATM  112  H   UNL     1       8.887  -4.753   0.952  1.00  0.00           H  
HETATM  113  H   UNL     1       7.634  -4.583  -0.301  1.00  0.00           H  
HETATM  114  H   UNL     1       7.576  -0.243   2.555  1.00  0.00           H  
HETATM  115  H   UNL     1       9.261  -0.490   0.728  1.00  0.00           H  
HETATM  116  H   UNL     1      11.189   0.126   1.813  1.00  0.00           H  
HETATM  117  H   UNL     1      11.209   1.315   0.489  1.00  0.00           H  
HETATM  118  H   UNL     1      11.453   1.850   2.169  1.00  0.00           H  
HETATM  119  H   UNL     1       9.527   5.292   1.634  1.00  0.00           H  
HETATM  120  H   UNL     1       8.701   6.506   0.818  1.00  0.00           H  
HETATM  121  H   UNL     1      11.598   0.833  -3.365  1.00  0.00           H  
HETATM  122  H   UNL     1      10.788   2.202  -4.162  1.00  0.00           H  
HETATM  123  H   UNL     1      11.617   2.443  -2.606  1.00  0.00           H  
HETATM  124  H   UNL     1       2.402  -4.513   1.701  1.00  0.00           H  
CONECT    1   57    2    4   65                                       
CONECT    2    3    1   56   66                                       
CONECT    3    2   67   68   69                                       
CONECT    4    1   61   53   70                                       
CONECT    5    6                                                      
CONECT    6    7    5   12   12                                       
CONECT    7    8    9    9    6                                       
CONECT    8    7                                                      
CONECT    9   10    7    7   11                                       
CONECT   10    9   71   72   73                                       
CONECT   11    9   12   74                                            
CONECT   12    6    6   11   13                                       
CONECT   13   12   15   14   14                                       
CONECT   14   13   13                                                 
CONECT   15   13   16   75                                            
CONECT   16   15   17   18   76                                       
CONECT   17   16   77   78   79                                       
CONECT   18   19   16   20   21                                       
CONECT   19   18   26   80   81                                       
CONECT   20   18   82                                                 
CONECT   21   18   23   22   83                                       
CONECT   22   21   84                                                 
CONECT   23   25   21   24   85                                       
CONECT   24   23   86   87   88                                       
CONECT   25   26   23                                                 
CONECT   26   19   27   25   89                                       
CONECT   27   28   26                                                 
CONECT   28   34   27   29   90                                       
CONECT   29   28   30   91   92                                       
CONECT   30   31   29   93   94                                       
CONECT   31   32   32   33   30                                       
CONECT   32   31   31   95  124                                       
CONECT   33   39   34   31   96                                       
CONECT   34   35   33   28   97                                       
CONECT   35   34   36   36   98                                       
CONECT   36   35   35   37   99                                       
CONECT   37   39   36   38  100                                       
CONECT   38   37  101  102  103                                       
CONECT   39   37   40   33  104                                       
CONECT   40   42   39   41   41                                       
CONECT   41   40   40                                                 
CONECT   42   43   45   45   40                                       
CONECT   43   44   44   51   42                                       
CONECT   44   43   43                                                 
CONECT   45   47   42   42   46                                       
CONECT   46   45  105                                                 
CONECT   47   51   48   45  106                                       
CONECT   48   49   47   50  107                                       
CONECT   49   48  108  109  110                                       
CONECT   50   48  111  112  113                                       
CONECT   51   52   43   47                                            
CONECT   52   56   53   51  114                                       
CONECT   53    4   52   54  115                                       
CONECT   54   53   55                                                 
CONECT   55   54  116  117  118                                       
CONECT   56    2   52                                                 
CONECT   57   58    1                                                 
CONECT   58   59   59   57   60                                       
CONECT   59   58   58                                                 
CONECT   60   58  119  120                                            
CONECT   61   62    4                                                 
CONECT   62   63   63   64   61                                       
CONECT   63   62   62                                                 
CONECT   64   62  121  122  123                                       
CONECT   65    1                                                      
CONECT   66    2                                                      
CONECT   67    3                                                      
CONECT   68    3                                                      
CONECT   69    3                                                      
CONECT   70    4                                                      
CONECT   71   10                                                      
CONECT   72   10                                                      
CONECT   73   10                                                      
CONECT   74   11                                                      
CONECT   75   15                                                      
CONECT   76   16                                                      
CONECT   77   17                                                      
CONECT   78   17                                                      
CONECT   79   17                                                      
CONECT   80   19                                                      
CONECT   81   19                                                      
CONECT   82   20                                                      
CONECT   83   21                                                      
CONECT   84   22                                                      
CONECT   85   23                                                      
CONECT   86   24                                                      
CONECT   87   24                                                      
CONECT   88   24                                                      
CONECT   89   26                                                      
CONECT   90   28                                                      
CONECT   91   29                                                      
CONECT   92   29                                                      
CONECT   93   30                                                      
CONECT   94   30                                                      
CONECT   95   32                                                      
CONECT   96   33                                                      
CONECT   97   34                                                      
CONECT   98   35                                                      
CONECT   99   36                                                      
CONECT  100   37                                                      
CONECT  101   38                                                      
CONECT  102   38                                                      
CONECT  103   38                                                      
CONECT  104   39                                                      
CONECT  105   46                                                      
CONECT  106   47                                                      
CONECT  107   48                                                      
CONECT  108   49                                                      
CONECT  109   49                                                      
CONECT  110   49                                                      
CONECT  111   50                                                      
CONECT  112   50                                                      
CONECT  113   50                                                      
CONECT  114   52                                                      
CONECT  115   53                                                      
CONECT  116   55                                                      
CONECT  117   55                                                      
CONECT  118   55                                                      
CONECT  119   60                                                      
CONECT  120   60                                                      
CONECT  121   64                                                      
CONECT  122   64                                                      
CONECT  123   64                                                      
CONECT  124   32                                                      
MASTER        0    0    0    0    0    0    0    0  124    0  124    0
END
