COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.581   3.925   0.974  1.00  0.00           C  
HETATM    2  O   UNL     1       2.269   2.647   1.010  1.00  0.00           O  
HETATM    3  C   UNL     1       2.921   2.202  -0.082  1.00  0.00           C  
HETATM    4  O   UNL     1       2.933   2.870  -1.098  1.00  0.00           O  
HETATM    5  C   UNL     1       3.619   0.907  -0.046  1.00  0.00           C  
HETATM    6  C   UNL     1       4.965   0.842   0.349  1.00  0.00           C  
HETATM    7  O   UNL     1       5.627   1.974   0.698  1.00  0.00           O  
HETATM    8  C   UNL     1       5.613  -0.380   0.381  1.00  0.00           C  
HETATM    9  C   UNL     1       4.935  -1.536   0.024  1.00  0.00           C  
HETATM   10  O   UNL     1       5.575  -2.732   0.056  1.00  0.00           O  
HETATM   11  C   UNL     1       3.600  -1.474  -0.368  1.00  0.00           C  
HETATM   12 CL   UNL     1       2.761  -2.928  -0.812  1.00  0.00          Cl  
HETATM   13  C   UNL     1       2.942  -0.266  -0.399  1.00  0.00           C  
HETATM   14  C   UNL     1       1.498  -0.204  -0.823  1.00  0.00           C  
HETATM   15  C   UNL     1       0.598  -0.371   0.403  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.846  -0.310  -0.021  1.00  0.00           C  
HETATM   17  O   UNL     1      -1.129  -0.148  -1.190  1.00  0.00           O  
HETATM   18  N   UNL     1      -1.824  -0.434   0.898  1.00  0.00           N  
HETATM   19  C   UNL     1      -3.165  -0.256   0.524  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.479   0.519  -0.583  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.803   0.695  -0.952  1.00  0.00           C  
HETATM   22  O   UNL     1      -5.111   1.455  -2.038  1.00  0.00           O  
HETATM   23  C   UNL     1      -5.817   0.095  -0.212  1.00  0.00           C  
HETATM   24  O   UNL     1      -7.117   0.268  -0.575  1.00  0.00           O  
HETATM   25  C   UNL     1      -7.908  -0.461   0.366  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.504  -0.679   0.894  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.180  -0.860   1.260  1.00  0.00           C  
HETATM   28  O   UNL     1      -3.872  -1.620   2.346  1.00  0.00           O  
HETATM   29  H   UNL     1       2.296   4.717   0.754  1.00  0.00           H  
HETATM   30  H   UNL     1       0.813   3.903   0.200  1.00  0.00           H  
HETATM   31  H   UNL     1       1.116   4.114   1.942  1.00  0.00           H  
HETATM   32  H   UNL     1       5.499   2.089   1.650  1.00  0.00           H  
HETATM   33  H   UNL     1       6.649  -0.433   0.683  1.00  0.00           H  
HETATM   34  H   UNL     1       5.443  -3.096   0.943  1.00  0.00           H  
HETATM   35  H   UNL     1       1.297   0.759  -1.292  1.00  0.00           H  
HETATM   36  H   UNL     1       1.294  -1.004  -1.535  1.00  0.00           H  
HETATM   37  H   UNL     1       0.799  -1.335   0.872  1.00  0.00           H  
HETATM   38  H   UNL     1       0.802   0.429   1.115  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.602  -0.647   1.817  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.692   0.985  -1.158  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.124   0.860  -2.800  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.634  -1.515   0.331  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.731  -0.072   1.368  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.963  -0.352   0.114  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.291  -1.144   1.468  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.763  -2.528   2.030  1.00  0.00           H  
CONECT    1    2   29   30   31                                       
CONECT    2    1    3                                                 
CONECT    3    2    4    4    5                                       
CONECT    4    3    3                                                 
CONECT    5    3    6   13   13                                       
CONECT    6    5    7    8    8                                       
CONECT    7    6   32                                                 
CONECT    8    6    6    9   33                                       
CONECT    9    8   10   11   11                                       
CONECT   10    9   34                                                 
CONECT   11    9    9   12   13                                       
CONECT   12   11                                                      
CONECT   13    5    5   11   14                                       
CONECT   14   13   15   35   36                                       
CONECT   15   14   16   37   38                                       
CONECT   16   15   17   17   18                                       
CONECT   17   16   16                                                 
CONECT   18   16   19   39                                            
CONECT   19   18   20   27   27                                       
CONECT   20   19   21   21   40                                       
CONECT   21   20   20   22   23                                       
CONECT   22   21   41                                                 
CONECT   23   21   24   26   26                                       
CONECT   24   23   25                                                 
CONECT   25   24   42   43   44                                       
CONECT   26   23   23   27   45                                       
CONECT   27   19   19   26   28                                       
CONECT   28   27   46                                                 
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34   10                                                      
CONECT   35   14                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   18                                                      
CONECT   40   20                                                      
CONECT   41   22                                                      
CONECT   42   25                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
CONECT   46   28                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
