COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.724   1.891  -1.973  1.00  0.00           C  
HETATM    2  O   UNL     1      -4.930  -0.696  -0.071  1.00  0.00           O  
HETATM    3  C   UNL     1       5.384   1.086  -1.409  1.00  0.00           C  
HETATM    4  C   UNL     1       4.366   0.678  -0.565  1.00  0.00           C  
HETATM    5  C   UNL     1       3.161   2.632   0.373  1.00  0.00           C  
HETATM    6  C   UNL     1       5.764  -1.092   0.257  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.605  -0.275   0.198  1.00  0.00           C  
HETATM    8  C   UNL     1       6.786  -0.676  -0.596  1.00  0.00           C  
HETATM    9  O   UNL     1      -6.893  -2.318  -0.619  1.00  0.00           O  
HETATM   10  O   UNL     1       0.469   2.134  -0.273  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.576   0.609   0.488  1.00  0.00           C  
HETATM   12  C   UNL     1       6.590   0.410  -1.424  1.00  0.00           C  
HETATM   13  C   UNL     1       4.549  -0.406   0.268  1.00  0.00           C  
HETATM   14  C   UNL     1       5.968  -2.255   1.147  1.00  0.00           C  
HETATM   15  C   UNL     1       6.170  -3.628   0.559  1.00  0.00           C  
HETATM   16  C   UNL     1       5.972  -2.090   2.463  1.00  0.00           C  
HETATM   17  C   UNL     1       0.729   0.986   0.029  1.00  0.00           C  
HETATM   18  C   UNL     1       3.054   1.420  -0.555  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.919   0.166   0.218  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.203   1.488   0.533  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.175   2.365   0.827  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.864   1.932   0.798  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.807  -2.844  -0.677  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.565  -2.041  -0.387  1.00  0.00           C  
HETATM   25  N   UNL     1       1.993   0.531  -0.077  1.00  0.00           N  
HETATM   26  N   UNL     1      -0.247   0.167   0.469  1.00  0.00           N  
HETATM   27  O   UNL     1      -5.707  -4.143  -1.000  1.00  0.00           O  
HETATM   28 CL   UNL     1      -5.848   2.040   0.558  1.00  0.00          Cl  
HETATM   29  H   UNL     1       3.513   2.553  -2.329  1.00  0.00           H  
HETATM   30  H   UNL     1       2.648   1.028  -2.634  1.00  0.00           H  
HETATM   31  H   UNL     1       1.775   2.428  -1.966  1.00  0.00           H  
HETATM   32  H   UNL     1       5.234   1.933  -2.062  1.00  0.00           H  
HETATM   33  H   UNL     1       2.212   3.169   0.380  1.00  0.00           H  
HETATM   34  H   UNL     1       3.396   2.297   1.383  1.00  0.00           H  
HETATM   35  H   UNL     1       3.950   3.294   0.016  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.383  -1.303  -0.047  1.00  0.00           H  
HETATM   37  H   UNL     1       7.729  -1.203  -0.609  1.00  0.00           H  
HETATM   38  H   UNL     1       7.381   0.734  -2.085  1.00  0.00           H  
HETATM   39  H   UNL     1       3.754  -0.723   0.926  1.00  0.00           H  
HETATM   40  H   UNL     1       7.234  -3.799   0.394  1.00  0.00           H  
HETATM   41  H   UNL     1       5.784  -4.379   1.248  1.00  0.00           H  
HETATM   42  H   UNL     1       5.639  -3.698  -0.390  1.00  0.00           H  
HETATM   43  H   UNL     1       6.121  -2.939   3.113  1.00  0.00           H  
HETATM   44  H   UNL     1       5.827  -1.106   2.884  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.398   3.393   1.072  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.063   2.620   1.024  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.917  -2.046  -1.263  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.037  -2.483   0.458  1.00  0.00           H  
HETATM   49  H   UNL     1       2.201  -0.386   0.164  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.029  -0.728   0.773  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.531  -4.616  -1.177  1.00  0.00           H  
CONECT    1   18   29   30   31                                       
CONECT    2   19   24                                                 
CONECT    3   12   12    4   32                                       
CONECT    4    3   18   13   13                                       
CONECT    5   18   33   34   35                                       
CONECT    6    8    8   13   14                                       
CONECT    7   11   11   19   36                                       
CONECT    8   12    6    6   37                                       
CONECT    9   23   23                                                 
CONECT   10   17   17                                                 
CONECT   11   26    7    7   22                                       
CONECT   12    3    3    8   38                                       
CONECT   13    4    4    6   39                                       
CONECT   14    6   16   16   15                                       
CONECT   15   14   40   41   42                                       
CONECT   16   14   14   43   44                                       
CONECT   17   25   10   10   26                                       
CONECT   18    1    5    4   25                                       
CONECT   19    7    2   20   20                                       
CONECT   20   19   19   21   28                                       
CONECT   21   22   22   20   45                                       
CONECT   22   11   21   21   46                                       
CONECT   23    9    9   27   24                                       
CONECT   24   23    2   47   48                                       
CONECT   25   18   17   49                                            
CONECT   26   17   11   50                                            
CONECT   27   23   51                                                 
CONECT   28   20                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    3                                                      
CONECT   33    5                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
