COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 CL   UNL     1       8.782   3.242   9.594  1.00  0.00          Cl  
HETATM    2  C   UNL     1       8.684   2.747  11.253  1.00  0.00           C  
HETATM    3  C   UNL     1       8.045   1.554  11.594  1.00  0.00           C  
HETATM    4  C   UNL     1       7.956   1.152  12.927  1.00  0.00           C  
HETATM    5  C   UNL     1       8.542   1.974  13.868  1.00  0.00           C  
HETATM    6  O   UNL     1       8.597   1.785  15.223  1.00  0.00           O  
HETATM    7  C   UNL     1       9.399   2.898  15.652  1.00  0.00           C  
HETATM    8  O   UNL     1       9.693   3.815  14.590  1.00  0.00           O  
HETATM    9  C   UNL     1       9.157   3.144  13.523  1.00  0.00           C  
HETATM   10  C   UNL     1       9.241   3.570  12.219  1.00  0.00           C  
HETATM   11  N   UNL     1       9.888   4.777  11.923  1.00  0.00           N  
HETATM   12  C   UNL     1      11.278   4.953  12.047  1.00  0.00           C  
HETATM   13  C   UNL     1      12.064   3.891  12.491  1.00  0.00           C  
HETATM   14  C   UNL     1      13.396   4.133  12.590  1.00  0.00           C  
HETATM   15  N   UNL     1      13.928   5.310  12.262  1.00  0.00           N  
HETATM   16  C   UNL     1      13.106   6.277  11.850  1.00  0.00           C  
HETATM   17  N   UNL     1      13.766   7.489  11.521  1.00  0.00           N  
HETATM   18  C   UNL     1      13.155   8.725  11.273  1.00  0.00           C  
HETATM   19  C   UNL     1      11.793   8.901  11.309  1.00  0.00           C  
HETATM   20  C   UNL     1      11.244  10.151  11.074  1.00  0.00           C  
HETATM   21  C   UNL     1      12.062  11.218  10.796  1.00  0.00           C  
HETATM   22  C   UNL     1      13.429  11.054  10.750  1.00  0.00           C  
HETATM   23  C   UNL     1      13.958   9.809  10.998  1.00  0.00           C  
HETATM   24  N   UNL     1      14.240  12.177  10.466  1.00  0.00           N  
HETATM   25  C   UNL     1      15.636  11.928  10.213  1.00  0.00           C  
HETATM   26  C   UNL     1      16.355  13.280  10.127  1.00  0.00           C  
HETATM   27  O   UNL     1      15.743  14.122   9.144  1.00  0.00           O  
HETATM   28  C   UNL     1      14.395  14.389   9.544  1.00  0.00           C  
HETATM   29  C   UNL     1      13.626  13.068   9.476  1.00  0.00           C  
HETATM   30  N   UNL     1      11.773   6.155  11.735  1.00  0.00           N  
HETATM   31  H   UNL     1       7.616   0.937  10.819  1.00  0.00           H  
HETATM   32  H   UNL     1       7.452   0.240  13.210  1.00  0.00           H  
HETATM   33  H   UNL     1       8.849   3.440  16.435  1.00  0.00           H  
HETATM   34  H   UNL     1      10.355   2.497  16.019  1.00  0.00           H  
HETATM   35  H   UNL     1       9.336   5.549  11.609  1.00  0.00           H  
HETATM   36  H   UNL     1      11.638   2.931  12.742  1.00  0.00           H  
HETATM   37  H   UNL     1      14.045   3.347  12.946  1.00  0.00           H  
HETATM   38  H   UNL     1      14.764   7.458  11.460  1.00  0.00           H  
HETATM   39  H   UNL     1      11.148   8.061  11.521  1.00  0.00           H  
HETATM   40  H   UNL     1      15.030   9.678  10.976  1.00  0.00           H  
HETATM   41  H   UNL     1      10.173  10.286  11.109  1.00  0.00           H  
HETATM   42  H   UNL     1      11.631  12.191  10.612  1.00  0.00           H  
HETATM   43  H   UNL     1      16.063  11.328  11.030  1.00  0.00           H  
HETATM   44  H   UNL     1      15.758  11.372   9.271  1.00  0.00           H  
HETATM   45  H   UNL     1      13.698  12.632   8.469  1.00  0.00           H  
HETATM   46  H   UNL     1      12.557  13.220   9.688  1.00  0.00           H  
HETATM   47  H   UNL     1      16.302  13.777  11.107  1.00  0.00           H  
HETATM   48  H   UNL     1      17.402  13.105   9.838  1.00  0.00           H  
HETATM   49  H   UNL     1      14.376  14.786  10.569  1.00  0.00           H  
HETATM   50  H   UNL     1      13.936  15.138   8.882  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3   10   10                                       
CONECT    3    2    4    4   31                                       
CONECT    4    3    3    5   32                                       
CONECT    5    4    6    9    9                                       
CONECT    6    5    7                                                 
CONECT    7    6    8   33   34                                       
CONECT    8    7    9                                                 
CONECT    9    5    5    8   10                                       
CONECT   10    2    2    9   11                                       
CONECT   11   10   12   35                                            
CONECT   12   11   13   30   30                                       
CONECT   13   12   14   14   36                                       
CONECT   14   13   13   15   37                                       
CONECT   15   14   16   16                                            
CONECT   16   15   15   17   30                                       
CONECT   17   16   18   38                                            
CONECT   18   17   19   23   23                                       
CONECT   19   18   20   20   39                                       
CONECT   20   19   19   21   41                                       
CONECT   21   20   22   22   42                                       
CONECT   22   21   21   23   24                                       
CONECT   23   18   18   22   40                                       
CONECT   24   22   25   29                                            
CONECT   25   24   26   43   44                                       
CONECT   26   25   27   47   48                                       
CONECT   27   26   28                                                 
CONECT   28   27   29   49   50                                       
CONECT   29   24   28   45   46                                       
CONECT   30   12   12   16                                            
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35   11                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   17                                                      
CONECT   39   19                                                      
CONECT   40   23                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
CONECT   45   29                                                      
CONECT   46   29                                                      
CONECT   47   26                                                      
CONECT   48   26                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
