COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.660   1.667   2.141  1.00  0.00           C  
HETATM    2  C   UNL     1       3.542   3.221   0.498  1.00  0.00           C  
HETATM    3  C   UNL     1       1.406   3.622  -0.569  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.138   0.252   1.525  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.135  -0.599   1.814  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.785   0.048  -1.690  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.957   1.561  -2.073  1.00  0.00           C  
HETATM    8  C   UNL     1       6.951  -3.026  -1.965  1.00  0.00           C  
HETATM    9  C   UNL     1       6.946  -3.006  -0.435  1.00  0.00           C  
HETATM   10  C   UNL     1       5.636  -3.608   0.078  1.00  0.00           C  
HETATM   11  C   UNL     1       8.125  -3.828   0.090  1.00  0.00           C  
HETATM   12  C   UNL     1       6.099  -0.777  -0.345  1.00  0.00           C  
HETATM   13  C   UNL     1       7.250   0.989   0.900  1.00  0.00           C  
HETATM   14  C   UNL     1       5.682   2.760   1.704  1.00  0.00           C  
HETATM   15  C   UNL     1       4.536   2.132   0.906  1.00  0.00           C  
HETATM   16  C   UNL     1       0.218   2.943  -1.253  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.554   1.438  -0.757  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.275   0.608   0.111  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.399  -0.092  -0.360  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.068   0.867  -2.533  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.619  -0.787   0.298  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.996  -0.536  -1.008  1.00  0.00           C  
HETATM   23  C   UNL     1      -8.095   0.262  -1.270  1.00  0.00           C  
HETATM   24  C   UNL     1      -8.816   0.808  -0.225  1.00  0.00           C  
HETATM   25  C   UNL     1      -8.439   0.557   1.081  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.341  -0.240   1.342  1.00  0.00           C  
HETATM   27  C   UNL     1       5.102   1.460  -0.349  1.00  0.00           C  
HETATM   28  N   UNL     1       6.149   0.510   0.054  1.00  0.00           N  
HETATM   29  N   UNL     1       2.384   2.604  -0.163  1.00  0.00           N  
HETATM   30  N   UNL     1      -3.896  -0.820   0.697  1.00  0.00           N  
HETATM   31  O   UNL     1       7.064  -1.637   0.032  1.00  0.00           O  
HETATM   32  O   UNL     1       5.182  -1.161  -1.044  1.00  0.00           O  
HETATM   33  O   UNL     1      -0.467   2.117  -0.308  1.00  0.00           O  
HETATM   34  O   UNL     1      -5.406  -2.323   1.943  1.00  0.00           O  
HETATM   35  O   UNL     1      -5.050  -2.637  -0.511  1.00  0.00           O  
HETATM   36  S   UNL     1      -5.223  -1.809   0.631  1.00  0.00           S  
HETATM   37  H   UNL     1       6.134   0.927   2.744  1.00  0.00           H  
HETATM   38  H   UNL     1       7.463   2.111   2.730  1.00  0.00           H  
HETATM   39  H   UNL     1       3.209   3.760   1.386  1.00  0.00           H  
HETATM   40  H   UNL     1       4.025   3.916  -0.189  1.00  0.00           H  
HETATM   41  H   UNL     1       1.875   4.319  -1.264  1.00  0.00           H  
HETATM   42  H   UNL     1       1.059   4.164   0.310  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.381   0.609   2.207  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.311  -1.043   2.782  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.647  -0.486  -2.061  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.405   2.199  -2.746  1.00  0.00           H  
HETATM   47  H   UNL     1       6.862  -4.055  -2.315  1.00  0.00           H  
HETATM   48  H   UNL     1       6.111  -2.441  -2.339  1.00  0.00           H  
HETATM   49  H   UNL     1       7.884  -2.597  -2.330  1.00  0.00           H  
HETATM   50  H   UNL     1       5.547  -4.637  -0.272  1.00  0.00           H  
HETATM   51  H   UNL     1       5.632  -3.594   1.168  1.00  0.00           H  
HETATM   52  H   UNL     1       4.796  -3.023  -0.296  1.00  0.00           H  
HETATM   53  H   UNL     1       9.058  -3.399  -0.276  1.00  0.00           H  
HETATM   54  H   UNL     1       8.121  -3.814   1.180  1.00  0.00           H  
HETATM   55  H   UNL     1       8.036  -4.856  -0.260  1.00  0.00           H  
HETATM   56  H   UNL     1       7.853   1.707   0.344  1.00  0.00           H  
HETATM   57  H   UNL     1       7.873   0.148   1.205  1.00  0.00           H  
HETATM   58  H   UNL     1       5.279   3.260   2.585  1.00  0.00           H  
HETATM   59  H   UNL     1       6.203   3.486   1.081  1.00  0.00           H  
HETATM   60  H   UNL     1       4.030   1.388   1.521  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.465   3.703  -1.633  1.00  0.00           H  
HETATM   62  H   UNL     1       0.576   2.330  -2.079  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.372   0.971  -3.564  1.00  0.00           H  
HETATM   64  H   UNL     1      -6.432  -0.963  -1.825  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.389   0.458  -2.290  1.00  0.00           H  
HETATM   66  H   UNL     1      -9.674   1.431  -0.429  1.00  0.00           H  
HETATM   67  H   UNL     1      -9.003   0.984   1.897  1.00  0.00           H  
HETATM   68  H   UNL     1      -7.046  -0.436   2.363  1.00  0.00           H  
HETATM   69  H   UNL     1       4.306   0.928  -0.869  1.00  0.00           H  
HETATM   70  H   UNL     1       5.529   2.217  -1.007  1.00  0.00           H  
HETATM   71  H   UNL     1       1.957   1.909   0.431  1.00  0.00           H  
CONECT    1   14   13   37   38                                       
CONECT    2   29   15   39   40                                       
CONECT    3   16   29   41   42                                       
CONECT    4   18    5    5   43                                       
CONECT    5    4    4   30   44                                       
CONECT    6   20   20   19   45                                       
CONECT    7   17   17   20   46                                       
CONECT    8    9   47   48   49                                       
CONECT    9   10    8   11   31                                       
CONECT   10    9   50   51   52                                       
CONECT   11    9   53   54   55                                       
CONECT   12   32   32   31   28                                       
CONECT   13   28    1   56   57                                       
CONECT   14   15    1   58   59                                       
CONECT   15    2   14   27   60                                       
CONECT   16   33    3   61   62                                       
CONECT   17   33    7    7   18                                       
CONECT   18   17   19   19    4                                       
CONECT   19   18   18    6   30                                       
CONECT   20    7    6    6   63                                       
CONECT   21   36   26   26   22                                       
CONECT   22   21   23   23   64                                       
CONECT   23   22   22   24   65                                       
CONECT   24   25   25   23   66                                       
CONECT   25   26   24   24   67                                       
CONECT   26   21   21   25   68                                       
CONECT   27   15   28   69   70                                       
CONECT   28   12   27   13                                            
CONECT   29    3    2   71                                            
CONECT   30   19    5   36                                            
CONECT   31    9   12                                                 
CONECT   32   12   12                                                 
CONECT   33   16   17                                                 
CONECT   34   36   36                                                 
CONECT   35   36   36                                                 
CONECT   36   30   35   35   34                                       
CONECT   36   34   21                                                 
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    2                                                      
CONECT   40    2                                                      
CONECT   41    3                                                      
CONECT   42    3                                                      
CONECT   43    4                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    7                                                      
CONECT   47    8                                                      
CONECT   48    8                                                      
CONECT   49    8                                                      
CONECT   50   10                                                      
CONECT   51   10                                                      
CONECT   52   10                                                      
CONECT   53   11                                                      
CONECT   54   11                                                      
CONECT   55   11                                                      
CONECT   56   13                                                      
CONECT   57   13                                                      
CONECT   58   14                                                      
CONECT   59   14                                                      
CONECT   60   15                                                      
CONECT   61   16                                                      
CONECT   62   16                                                      
CONECT   63   20                                                      
CONECT   64   22                                                      
CONECT   65   23                                                      
CONECT   66   24                                                      
CONECT   67   25                                                      
CONECT   68   26                                                      
CONECT   69   27                                                      
CONECT   70   27                                                      
CONECT   71   29                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
