COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.779  -2.118   0.352  1.00  0.00           C  
HETATM    2  C   UNL     1       1.089  -0.835   0.809  1.00  0.00           C  
HETATM    3  C   UNL     1       0.067   0.065   1.107  1.00  0.00           C  
HETATM    4  C   UNL     1       2.507  -0.446   0.949  1.00  0.00           C  
HETATM    5  C   UNL     1       3.118  -2.354  -0.455  1.00  0.00           C  
HETATM    6  C   UNL     1       5.370   0.115  -0.263  1.00  0.00           C  
HETATM    7  C   UNL     1       6.094   2.342  -0.725  1.00  0.00           C  
HETATM    8  C   UNL     1       6.777   3.054  -2.994  1.00  0.00           C  
HETATM    9  C   UNL     1       5.421   1.734   1.631  1.00  0.00           C  
HETATM   10  C   UNL     1       6.735   1.557   2.394  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.593   0.116   0.953  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.335  -0.158  -0.816  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.255  -0.319   0.933  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.554  -1.590   0.465  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.538  -2.487   0.176  1.00  0.00           C  
HETATM   16 CL   UNL     1       0.446   1.654   1.693  1.00  0.00          Cl  
HETATM   17  N   UNL     1       3.462  -1.226   0.409  1.00  0.00           N  
HETATM   18  C   UNL     1       1.893  -3.094   0.076  1.00  0.00           C  
HETATM   19  C   UNL     1       4.871  -0.940   0.691  1.00  0.00           C  
HETATM   20  C   UNL     1       5.630   1.378   0.181  1.00  0.00           C  
HETATM   21  C   UNL     1       6.278   2.013  -2.025  1.00  0.00           C  
HETATM   22  N   UNL     1       6.028   0.752  -2.464  1.00  0.00           N  
HETATM   23  C   UNL     1       5.577  -0.194  -1.618  1.00  0.00           C  
HETATM   24  O   UNL     1       5.349  -1.320  -2.029  1.00  0.00           O  
HETATM   25  O   UNL     1       2.809   0.569   1.546  1.00  0.00           O  
HETATM   26 CL   UNL     1      -0.924  -4.075  -0.408  1.00  0.00          Cl  
HETATM   27  O   UNL     1      -2.258   0.552   1.220  1.00  0.00           O  
HETATM   28  C   UNL     1      -3.917   0.343  -0.525  1.00  0.00           C  
HETATM   29  N   UNL     1      -6.267   0.497   0.113  1.00  0.00           N  
HETATM   30  C   UNL     1      -5.998   0.417   1.556  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.572   0.911   1.819  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.347   1.157  -0.349  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.674   1.131  -1.820  1.00  0.00           C  
HETATM   34  C   UNL     1      -8.112  -0.279  -2.220  1.00  0.00           C  
HETATM   35  O   UNL     1      -8.731   2.053  -2.089  1.00  0.00           O  
HETATM   36  O   UNL     1      -8.056   1.772   0.419  1.00  0.00           O  
HETATM   37  H   UNL     1       2.907  -1.985  -1.458  1.00  0.00           H  
HETATM   38  H   UNL     1       3.961  -3.043  -0.497  1.00  0.00           H  
HETATM   39  H   UNL     1       6.303   3.346  -0.387  1.00  0.00           H  
HETATM   40  H   UNL     1       7.866   3.032  -3.021  1.00  0.00           H  
HETATM   41  H   UNL     1       6.384   2.842  -3.989  1.00  0.00           H  
HETATM   42  H   UNL     1       6.441   4.040  -2.673  1.00  0.00           H  
HETATM   43  H   UNL     1       4.661   1.081   2.059  1.00  0.00           H  
HETATM   44  H   UNL     1       5.094   2.771   1.707  1.00  0.00           H  
HETATM   45  H   UNL     1       7.063   0.521   2.318  1.00  0.00           H  
HETATM   46  H   UNL     1       7.495   2.211   1.965  1.00  0.00           H  
HETATM   47  H   UNL     1       6.584   1.815   3.442  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.681  -0.945   1.186  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.607   0.091  -1.842  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.379  -1.238  -0.677  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.584  -1.883   0.326  1.00  0.00           H  
HETATM   52  H   UNL     1       2.155  -3.614   0.997  1.00  0.00           H  
HETATM   53  H   UNL     1       1.561  -3.821  -0.666  1.00  0.00           H  
HETATM   54  H   UNL     1       5.459  -1.849   0.566  1.00  0.00           H  
HETATM   55  H   UNL     1       4.971  -0.580   1.715  1.00  0.00           H  
HETATM   56  H   UNL     1       6.173   0.532  -3.397  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.852   1.407  -0.753  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.204  -0.206  -1.142  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.708   1.045   2.094  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.097  -0.615   1.890  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.326   0.768   2.872  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.502   1.970   1.570  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.791   1.413  -2.393  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.263  -0.320  -3.299  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.341  -0.994  -1.933  1.00  0.00           H  
HETATM   66  H   UNL     1      -9.045  -0.527  -1.713  1.00  0.00           H  
HETATM   67  H   UNL     1      -9.550   1.863  -1.612  1.00  0.00           H  
CONECT    1   18   15   15    2                                       
CONECT    2    1    4    3    3                                       
CONECT    3    2    2   13   16                                       
CONECT    4   17    2   25   25                                       
CONECT    5   18   17   37   38                                       
CONECT    6   23   19   20   20                                       
CONECT    7   21   21   20   39                                       
CONECT    8   21   40   41   42                                       
CONECT    9   20   10   43   44                                       
CONECT   10    9   45   46   47                                       
CONECT   11   28   27   31   48                                       
CONECT   12   28   29   49   50                                       
CONECT   13   14   14    3   27                                       
CONECT   14   15   13   13   51                                       
CONECT   15   26    1    1   14                                       
CONECT   16    3                                                      
CONECT   17    5   19    4                                            
CONECT   18    5    1   52   53                                       
CONECT   19   17    6   54   55                                       
CONECT   20    6    6    7    9                                       
CONECT   21   22    8    7    7                                       
CONECT   22   23   21   56                                            
CONECT   23   24   24   22    6                                       
CONECT   24   23   23                                                 
CONECT   25    4    4                                                 
CONECT   26   15                                                      
CONECT   27   13   11                                                 
CONECT   28   12   11   57   58                                       
CONECT   29   12   32   30                                            
CONECT   30   29   31   59   60                                       
CONECT   31   11   30   61   62                                       
CONECT   32   33   29   36   36                                       
CONECT   33   34   35   32   63                                       
CONECT   34   33   64   65   66                                       
CONECT   35   33   67                                                 
CONECT   36   32   32                                                 
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   10                                                      
CONECT   47   10                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   12                                                      
CONECT   51   14                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   22                                                      
CONECT   57   28                                                      
CONECT   58   28                                                      
CONECT   59   30                                                      
CONECT   60   30                                                      
CONECT   61   31                                                      
CONECT   62   31                                                      
CONECT   63   33                                                      
CONECT   64   34                                                      
CONECT   65   34                                                      
CONECT   66   34                                                      
CONECT   67   35                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
