COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.641  -0.102   0.052  1.00  0.00           C  
HETATM    2  C   UNL     1       4.764  -1.160  -0.830  1.00  0.00           C  
HETATM    3  C   UNL     1       3.648  -1.894  -1.191  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.284  -0.346  -0.390  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.205  -1.370  -0.139  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.988  -2.256   0.918  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.866  -2.129   1.710  1.00  0.00           C  
HETATM    8  C   UNL     1       0.400  -1.354   1.546  1.00  0.00           C  
HETATM    9  C   UNL     1       0.016   0.268  -0.360  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.163  -0.227   0.410  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.949  -1.117   1.455  1.00  0.00           C  
HETATM   12  C   UNL     1       0.935  -0.160   0.780  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.401  -1.512  -0.989  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.006   3.117  -0.613  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.448   4.207  -1.604  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.259   5.215  -0.457  1.00  0.00           C  
HETATM   17  N   UNL     1      -1.239   0.808   0.169  1.00  0.00           N  
HETATM   18  O   UNL     1      -0.822  -1.018   2.212  1.00  0.00           O  
HETATM   19  O   UNL     1      -5.589  -0.740  -1.908  1.00  0.00           O  
HETATM   20  O   UNL     1      -6.287  -2.498  -0.746  1.00  0.00           O  
HETATM   21  C   UNL     1      -1.803   1.817  -0.738  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.506   4.043   0.508  1.00  0.00           C  
HETATM   23  C   UNL     1       2.410  -1.570  -0.669  1.00  0.00           C  
HETATM   24  C   UNL     1       2.286  -0.513   0.212  1.00  0.00           C  
HETATM   25  C   UNL     1       3.401   0.222   0.574  1.00  0.00           C  
HETATM   26 CL   UNL     1       3.247   1.544   1.687  1.00  0.00          Cl  
HETATM   27 CL   UNL     1       6.319  -1.567  -1.486  1.00  0.00          Cl  
HETATM   28  H   UNL     1       5.512   0.468   0.337  1.00  0.00           H  
HETATM   29  H   UNL     1       3.744  -2.720  -1.879  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.446   0.343  -1.206  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.700  -3.043   1.117  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.702  -2.812   2.530  1.00  0.00           H  
HETATM   33  H   UNL     1       0.226  -2.177   0.852  1.00  0.00           H  
HETATM   34  H   UNL     1       1.133  -1.661   2.292  1.00  0.00           H  
HETATM   35  H   UNL     1       0.516   1.037  -0.950  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.203  -0.588  -0.998  1.00  0.00           H  
HETATM   37  H   UNL     1       1.054   0.675   1.471  1.00  0.00           H  
HETATM   38  H   UNL     1       0.072   2.953  -0.596  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.753   4.353  -2.431  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.482   4.106  -1.932  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.251   5.624  -0.397  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.031   5.983  -0.419  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.056  -2.551  -1.330  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.844   2.002  -0.474  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.747   1.454  -1.764  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.557   3.897   0.758  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.859   4.056   1.385  1.00  0.00           H  
HETATM   48  H   UNL     1       1.538  -2.143  -0.951  1.00  0.00           H  
CONECT    1    2   25   25   28                                       
CONECT    2   27    3    3    1                                       
CONECT    3    2    2   23   29                                       
CONECT    4   10   10    5   30                                       
CONECT    5    6    6    4   13                                       
CONECT    6    7    5    5   31                                       
CONECT    7   11   11    6   32                                       
CONECT    8   18   12   33   34                                       
CONECT    9   12   17   35   36                                       
CONECT   10   11   17    4    4                                       
CONECT   11   18    7    7   10                                       
CONECT   12   24    8    9   37                                       
CONECT   13    5   19   19   20                                       
CONECT   14   22   21   15   38                                       
CONECT   15   14   16   39   40                                       
CONECT   16   22   15   41   42                                       
CONECT   17    9   10   21                                            
CONECT   18    8   11                                                 
CONECT   19   13   13                                                 
CONECT   20   13   43                                                 
CONECT   21   17   14   44   45                                       
CONECT   22   14   16   46   47                                       
CONECT   23    3   24   24   48                                       
CONECT   24   23   23   25   12                                       
CONECT   25    1    1   24   26                                       
CONECT   26   25                                                      
CONECT   27    2                                                      
CONECT   28    1                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   12                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
