COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.618   0.043  -1.620  1.00  0.00           C  
HETATM    2  C   UNL     1       5.561  -1.121  -1.302  1.00  0.00           C  
HETATM    3  C   UNL     1       5.982  -1.036   0.169  1.00  0.00           C  
HETATM    4  C   UNL     1       4.731  -1.044   1.051  1.00  0.00           C  
HETATM    5  C   UNL     1       5.140  -0.899   2.518  1.00  0.00           C  
HETATM    6  C   UNL     1       3.420  -0.006  -0.668  1.00  0.00           C  
HETATM    7  O   UNL     1       2.564   1.109  -0.922  1.00  0.00           O  
HETATM    8  O   UNL     1       4.163  -0.066  -2.970  1.00  0.00           O  
HETATM    9  O   UNL     1       6.719  -1.041  -2.136  1.00  0.00           O  
HETATM   10  O   UNL     1       6.804  -2.158   0.496  1.00  0.00           O  
HETATM   11  O   UNL     1       3.883   0.046   0.682  1.00  0.00           O  
HETATM   12  O   UNL     1       3.984  -1.021   3.349  1.00  0.00           O  
HETATM   13  C   UNL     1       0.266   0.353  -0.940  1.00  0.00           C  
HETATM   14  C   UNL     1       1.354   1.098  -0.161  1.00  0.00           C  
HETATM   15  C   UNL     1       0.893   2.537   0.089  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.444   2.514   0.835  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.941   3.947   1.036  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.046   0.414  -0.154  1.00  0.00           C  
HETATM   19  O   UNL     1      -2.080  -0.230  -0.901  1.00  0.00           O  
HETATM   20  O   UNL     1       0.654  -1.010  -1.118  1.00  0.00           O  
HETATM   21  O   UNL     1       1.868   3.221   0.877  1.00  0.00           O  
HETATM   22  O   UNL     1      -1.402   1.780   0.071  1.00  0.00           O  
HETATM   23  O   UNL     1      -2.127   3.933   1.833  1.00  0.00           O  
HETATM   24  C   UNL     1      -3.367  -1.639   0.586  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.325  -0.329  -0.206  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.477  -0.317  -1.214  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.801  -0.501  -0.467  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.952  -0.551  -1.473  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.734  -1.773   1.264  1.00  0.00           C  
HETATM   30  O   UNL     1      -4.801  -3.020   1.958  1.00  0.00           O  
HETATM   31  O   UNL     1      -2.339  -1.631   1.579  1.00  0.00           O  
HETATM   32  O   UNL     1      -4.491   0.932  -1.908  1.00  0.00           O  
HETATM   33  O   UNL     1      -5.762  -1.723   0.273  1.00  0.00           O  
HETATM   34  O   UNL     1      -8.196  -0.606  -0.772  1.00  0.00           O  
HETATM   35  H   UNL     1       5.148   0.987  -1.489  1.00  0.00           H  
HETATM   36  H   UNL     1       5.047  -2.066  -1.480  1.00  0.00           H  
HETATM   37  H   UNL     1       6.540  -0.115   0.335  1.00  0.00           H  
HETATM   38  H   UNL     1       4.196  -1.983   0.914  1.00  0.00           H  
HETATM   39  H   UNL     1       5.857  -1.679   2.774  1.00  0.00           H  
HETATM   40  H   UNL     1       5.597   0.079   2.673  1.00  0.00           H  
HETATM   41  H   UNL     1       2.867  -0.932  -0.828  1.00  0.00           H  
HETATM   42  H   UNL     1       3.560   0.640  -3.240  1.00  0.00           H  
HETATM   43  H   UNL     1       6.525  -1.082  -3.082  1.00  0.00           H  
HETATM   44  H   UNL     1       7.614  -2.219  -0.029  1.00  0.00           H  
HETATM   45  H   UNL     1       4.170  -0.939   4.295  1.00  0.00           H  
HETATM   46  H   UNL     1       0.129   0.823  -1.914  1.00  0.00           H  
HETATM   47  H   UNL     1       1.527   0.599   0.792  1.00  0.00           H  
HETATM   48  H   UNL     1       0.770   3.052  -0.864  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.310   2.037   1.806  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.171   4.532   1.541  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.160   4.395   0.067  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.920  -0.091   0.803  1.00  0.00           H  
HETATM   53  H   UNL     1       0.010  -1.543  -1.604  1.00  0.00           H  
HETATM   54  H   UNL     1       1.641   4.140   1.075  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.499   4.810   2.001  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.213  -2.479  -0.091  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.430   0.514   0.478  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.345  -1.129  -1.929  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.952   0.333   0.217  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.927   0.342  -2.098  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.849  -1.436  -2.100  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.870  -0.955   1.971  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.641  -3.173   2.412  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.308  -2.433   2.119  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.198   1.010  -2.565  1.00  0.00           H  
HETATM   66  H   UNL     1      -8.972  -0.639  -1.348  1.00  0.00           H  
CONECT    1    6    8    2   35                                       
CONECT    2    1    3    9   36                                       
CONECT    3    4    2   10   37                                       
CONECT    4    5   11    3   38                                       
CONECT    5    4   12   39   40                                       
CONECT    6   11    7    1   41                                       
CONECT    7   14    6                                                 
CONECT    8    1   42                                                 
CONECT    9    2   43                                                 
CONECT   10    3   44                                                 
CONECT   11    4    6                                                 
CONECT   12    5   45                                                 
CONECT   13   20   18   14   46                                       
CONECT   14   13    7   15   47                                       
CONECT   15   14   16   21   48                                       
CONECT   16   22   15   17   49                                       
CONECT   17   16   23   50   51                                       
CONECT   18   19   13   22   52                                       
CONECT   19   25   18                                                 
CONECT   20   13   53                                                 
CONECT   21   15   54                                                 
CONECT   22   18   16                                                 
CONECT   23   17   55                                                 
CONECT   24   29   31   25   56                                       
CONECT   25   24   26   19   57                                       
CONECT   26   27   25   32   58                                       
CONECT   27   33   28   26   59                                       
CONECT   28   34   27   60   61                                       
CONECT   29   30   33   24   62                                       
CONECT   30   29   63                                                 
CONECT   31   24   64                                                 
CONECT   32   26   65                                                 
CONECT   33   29   27                                                 
CONECT   34   28   66                                                 
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   20                                                      
CONECT   54   21                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   25                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   28                                                      
CONECT   61   28                                                      
CONECT   62   29                                                      
CONECT   63   30                                                      
CONECT   64   31                                                      
CONECT   65   32                                                      
CONECT   66   34                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
