COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1       3.730   0.873   0.441  1.00  0.00           C  
HETATM    2  C   UNL     1       4.700   1.222  -0.691  1.00  0.00           C  
HETATM    3  C   UNL     1       4.867   0.004  -1.604  1.00  0.00           C  
HETATM    4  C   UNL     1       5.354  -1.184  -0.767  1.00  0.00           C  
HETATM    5  C   UNL     1       4.359  -1.440   0.368  1.00  0.00           C  
HETATM    6  C   UNL     1       4.869  -2.586   1.244  1.00  0.00           C  
HETATM    7  O   UNL     1       4.176   2.316  -1.447  1.00  0.00           O  
HETATM    8  O   UNL     1       5.826   0.297  -2.622  1.00  0.00           O  
HETATM    9  O   UNL     1       5.444  -2.346  -1.594  1.00  0.00           O  
HETATM   10  O   UNL     1       4.227  -0.258   1.160  1.00  0.00           O  
HETATM   11  O   UNL     1       3.900  -2.884   2.251  1.00  0.00           O  
HETATM   12  C   UNL     1       1.678  -0.154   2.074  1.00  0.00           C  
HETATM   13  C   UNL     1       1.373   0.677   0.826  1.00  0.00           C  
HETATM   14  C   UNL     1       1.169   2.154   1.214  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.296   2.453   0.814  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.915   1.033   0.763  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.133   1.009  -0.163  1.00  0.00           C  
HETATM   18  O   UNL     1       1.698  -1.541   1.730  1.00  0.00           O  
HETATM   19  O   UNL     1       2.448   0.563  -0.108  1.00  0.00           O  
HETATM   20  O   UNL     1       2.068   2.991   0.482  1.00  0.00           O  
HETATM   21  O   UNL     1      -0.942   3.255   1.806  1.00  0.00           O  
HETATM   22  O   UNL     1       0.150   0.221   0.223  1.00  0.00           O  
HETATM   23  O   UNL     1      -2.660  -0.318  -0.223  1.00  0.00           O  
HETATM   24  C   UNL     1      -3.527  -0.095  -2.473  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.842  -0.438  -1.016  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.391  -1.878  -0.922  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.505  -1.737   0.151  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.022  -0.307  -0.148  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.668   0.296   1.101  1.00  0.00           C  
HETATM   30  O   UNL     1      -3.201   1.292  -2.576  1.00  0.00           O  
HETATM   31  O   UNL     1      -3.375  -2.783  -0.484  1.00  0.00           O  
HETATM   32  O   UNL     1      -6.535  -2.708  -0.045  1.00  0.00           O  
HETATM   33  O   UNL     1      -4.854   0.444  -0.517  1.00  0.00           O  
HETATM   34  O   UNL     1      -7.182   1.593   0.792  1.00  0.00           O  
HETATM   35  H   UNL     1       3.640   1.723   1.118  1.00  0.00           H  
HETATM   36  H   UNL     1       5.667   1.498  -0.271  1.00  0.00           H  
HETATM   37  H   UNL     1       3.909  -0.242  -2.063  1.00  0.00           H  
HETATM   38  H   UNL     1       6.335  -0.957  -0.349  1.00  0.00           H  
HETATM   39  H   UNL     1       3.389  -1.707  -0.052  1.00  0.00           H  
HETATM   40  H   UNL     1       5.806  -2.293   1.717  1.00  0.00           H  
HETATM   41  H   UNL     1       5.035  -3.470   0.627  1.00  0.00           H  
HETATM   42  H   UNL     1       4.040   3.122  -0.930  1.00  0.00           H  
HETATM   43  H   UNL     1       5.585   1.044  -3.186  1.00  0.00           H  
HETATM   44  H   UNL     1       6.055  -2.252  -2.339  1.00  0.00           H  
HETATM   45  H   UNL     1       4.122  -3.651   2.796  1.00  0.00           H  
HETATM   46  H   UNL     1       0.908   0.022   2.826  1.00  0.00           H  
HETATM   47  H   UNL     1       2.649   0.135   2.475  1.00  0.00           H  
HETATM   48  H   UNL     1       1.310   2.290   2.286  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.343   2.934  -0.163  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.185   0.695   1.763  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.836   1.328  -1.162  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.895   1.686   0.223  1.00  0.00           H  
HETATM   53  H   UNL     1       1.776  -2.134   2.490  1.00  0.00           H  
HETATM   54  H   UNL     1       1.983   3.932   0.687  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.885   3.394   1.646  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.396  -0.312  -3.094  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.681  -0.693  -2.812  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.807  -2.198  -1.877  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.092  -1.804   1.158  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.735  -0.327  -0.972  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.923   0.380   1.892  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.482  -0.347   1.436  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.990   1.581  -3.474  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.671  -3.700  -0.409  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.252  -2.657   0.603  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.608   2.036   1.539  1.00  0.00           H  
CONECT    1   10   19    2   35                                       
CONECT    2    1    3    7   36                                       
CONECT    3    2    4    8   37                                       
CONECT    4    3    9    5   38                                       
CONECT    5    4   10    6   39                                       
CONECT    6    5   11   41   40                                       
CONECT    7    2   42                                                 
CONECT    8    3   43                                                 
CONECT    9    4   44                                                 
CONECT   10    1    5                                                 
CONECT   11    6   45                                                 
CONECT   12   18   13   46   47                                       
CONECT   13   19   22   14   12                                       
CONECT   14   20   13   15   48                                       
CONECT   15   21   16   14   49                                       
CONECT   16   22   15   17   50                                       
CONECT   17   23   16   51   52                                       
CONECT   18   12   53                                                 
CONECT   19    1   13                                                 
CONECT   20   14   54                                                 
CONECT   21   15   55                                                 
CONECT   22   13   16                                                 
CONECT   23   25   17                                                 
CONECT   24   30   25   56   57                                       
CONECT   25   23   33   26   24                                       
CONECT   26   31   25   27   58                                       
CONECT   27   32   26   28   59                                       
CONECT   28   33   27   29   60                                       
CONECT   29   34   28   61   62                                       
CONECT   30   24   63                                                 
CONECT   31   26   64                                                 
CONECT   32   27   65                                                 
CONECT   33   28   25                                                 
CONECT   34   29   66                                                 
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   14                                                      
CONECT   49   15                                                      
CONECT   50   16                                                      
CONECT   51   17                                                      
CONECT   52   17                                                      
CONECT   53   18                                                      
CONECT   54   20                                                      
CONECT   55   21                                                      
CONECT   56   24                                                      
CONECT   57   24                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   28                                                      
CONECT   61   29                                                      
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
