COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.481  -2.161   0.572  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.554  -3.163   0.754  1.00  0.00           C  
HETATM    3  C   UNL     1       0.802  -2.889   0.622  1.00  0.00           C  
HETATM    4  C   UNL     1       1.219  -1.588   0.305  1.00  0.00           C  
HETATM    5  C   UNL     1       0.275  -0.578   0.123  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.071  -0.867   0.257  1.00  0.00           C  
HETATM    7  N   UNL     1      -2.023   0.142   0.075  1.00  0.00           N  
HETATM    8  C   UNL     1      -3.449  -0.163   0.216  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.268   1.106  -0.032  1.00  0.00           C  
HETATM   10  N   UNL     1      -5.698   0.800   0.110  1.00  0.00           N  
HETATM   11  C   UNL     1      -6.502   2.031   0.115  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.975   1.672   0.324  1.00  0.00           C  
HETATM   13  O   UNL     1      -8.388   0.760  -0.698  1.00  0.00           O  
HETATM   14  C   UNL     1      -7.626  -0.451  -0.731  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.149  -0.112  -0.951  1.00  0.00           C  
HETATM   16  C   UNL     1       2.690  -1.626   0.239  1.00  0.00           C  
HETATM   17  N   UNL     1       3.056  -2.854   0.500  1.00  0.00           N  
HETATM   18  O   UNL     1       1.912  -3.649   0.739  1.00  0.00           O  
HETATM   19  C   UNL     1       3.586  -0.488  -0.066  1.00  0.00           C  
HETATM   20  C   UNL     1       3.395   0.741   0.565  1.00  0.00           C  
HETATM   21  C   UNL     1       4.232   1.799   0.280  1.00  0.00           C  
HETATM   22  C   UNL     1       5.266   1.645  -0.637  1.00  0.00           C  
HETATM   23  C   UNL     1       5.462   0.426  -1.269  1.00  0.00           C  
HETATM   24  C   UNL     1       4.631  -0.643  -0.984  1.00  0.00           C  
HETATM   25  O   UNL     1       4.826  -1.839  -1.598  1.00  0.00           O  
HETATM   26  O   UNL     1       6.087   2.692  -0.914  1.00  0.00           O  
HETATM   27 CL   UNL     1       3.993   3.329   1.066  1.00  0.00          Cl  
HETATM   28  H   UNL     1      -2.534  -2.380   0.671  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.881  -4.163   0.998  1.00  0.00           H  
HETATM   30  H   UNL     1       0.593   0.425  -0.122  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.739   1.043  -0.145  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.731  -0.925  -0.510  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.644  -0.530   1.224  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.986   1.868   0.694  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.073   1.473  -1.039  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.168   2.681   0.923  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.385   2.546  -0.839  1.00  0.00           H  
HETATM   38  H   UNL     1      -8.101   1.205   1.300  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.582   2.576   0.271  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.742  -0.979   0.215  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.981  -1.081  -1.546  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.027   0.368  -1.921  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.558  -1.028  -0.919  1.00  0.00           H  
HETATM   44  H   UNL     1       2.593   0.864   1.277  1.00  0.00           H  
HETATM   45  H   UNL     1       6.266   0.311  -1.981  1.00  0.00           H  
HETATM   46  H   UNL     1       4.344  -1.937  -2.431  1.00  0.00           H  
HETATM   47  H   UNL     1       6.865   2.744  -0.343  1.00  0.00           H  
CONECT    1    2    2    6   28                                       
CONECT    2    1    1    3   29                                       
CONECT    3    2    4    4   18                                       
CONECT    4    3    3    5   16                                       
CONECT    5    4    6    6   30                                       
CONECT    6    1    5    5    7                                       
CONECT    7    6    8   31                                            
CONECT    8    7    9   32   33                                       
CONECT    9    8   10   34   35                                       
CONECT   10    9   11   15                                            
CONECT   11   10   12   36   37                                       
CONECT   12   11   13   38   39                                       
CONECT   13   12   14                                                 
CONECT   14   13   15   40   41                                       
CONECT   15   10   14   42   43                                       
CONECT   16    4   17   17   19                                       
CONECT   17   16   16   18                                            
CONECT   18    3   17                                                 
CONECT   19   16   20   20   24                                       
CONECT   20   19   19   21   44                                       
CONECT   21   20   22   22   27                                       
CONECT   22   21   21   23   26                                       
CONECT   23   22   24   24   45                                       
CONECT   24   19   23   23   25                                       
CONECT   25   24   46                                                 
CONECT   26   22   47                                                 
CONECT   27   21                                                      
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    5                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   20                                                      
CONECT   45   23                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
