COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.983   0.500  -1.063  1.00  0.00           C  
HETATM    2  C   UNL     1       7.867   1.510   1.657  1.00  0.00           C  
HETATM    3  C   UNL     1       5.408  -2.497   1.665  1.00  0.00           C  
HETATM    4  C   UNL     1       2.161  -1.863  -1.052  1.00  0.00           C  
HETATM    5  C   UNL     1       0.947  -2.159  -0.207  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.201  -2.526  -0.780  1.00  0.00           C  
HETATM    7  C   UNL     1       2.685   1.630  -0.075  1.00  0.00           C  
HETATM    8  C   UNL     1       1.563   2.483  -0.608  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.366  -2.740   0.000  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.578  -2.507  -0.556  1.00  0.00           C  
HETATM   11  C   UNL     1       0.962   3.336   0.184  1.00  0.00           C  
HETATM   12  C   UNL     1       3.044  -0.841  -0.329  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.172   4.186  -0.330  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.763  -2.585   0.189  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.351   1.710   0.405  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.882   3.730   0.414  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.123   2.364  -0.235  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.049  -1.533   0.676  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.726  -1.576   0.064  1.00  0.00           C  
HETATM   20  C   UNL     1       4.346   0.735  -1.725  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.754   0.468  -0.393  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.542  -0.386  -0.683  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.482   3.636   0.171  1.00  0.00           C  
HETATM   24  C   UNL     1       5.262  -0.429  -1.337  1.00  0.00           C  
HETATM   25  C   UNL     1       4.500  -1.321  -0.351  1.00  0.00           C  
HETATM   26  C   UNL     1       6.510   0.095  -0.622  1.00  0.00           C  
HETATM   27  C   UNL     1       6.452  -0.377   0.833  1.00  0.00           C  
HETATM   28  C   UNL     1       5.135  -1.133   1.029  1.00  0.00           C  
HETATM   29  C   UNL     1       6.502   0.831   1.772  1.00  0.00           C  
HETATM   30  N   UNL     1      -2.632   4.310  -0.112  1.00  0.00           N  
HETATM   31  N   UNL     1      -6.659  -0.366   0.409  1.00  0.00           N  
HETATM   32  O   UNL     1      -3.979  -3.626   1.019  1.00  0.00           O  
HETATM   33  O   UNL     1      -6.535  -2.432   1.339  1.00  0.00           O  
HETATM   34  O   UNL     1      -3.605  -0.110  -1.405  1.00  0.00           O  
HETATM   35  O   UNL     1      -1.513   2.609   0.816  1.00  0.00           O  
HETATM   36  O   UNL     1       2.901  -3.067  -1.263  1.00  0.00           O  
HETATM   37  H   UNL     1       2.205   0.464  -1.827  1.00  0.00           H  
HETATM   38  H   UNL     1       8.024   1.841   0.631  1.00  0.00           H  
HETATM   39  H   UNL     1       7.903   2.370   2.326  1.00  0.00           H  
HETATM   40  H   UNL     1       8.650   0.803   1.934  1.00  0.00           H  
HETATM   41  H   UNL     1       6.089  -3.064   1.030  1.00  0.00           H  
HETATM   42  H   UNL     1       5.860  -2.357   2.647  1.00  0.00           H  
HETATM   43  H   UNL     1       4.471  -3.044   1.771  1.00  0.00           H  
HETATM   44  H   UNL     1       1.846  -1.456  -2.013  1.00  0.00           H  
HETATM   45  H   UNL     1       1.017  -2.066   0.868  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.254  -2.640  -1.856  1.00  0.00           H  
HETATM   47  H   UNL     1       2.393   1.205   0.885  1.00  0.00           H  
HETATM   48  H   UNL     1       3.576   2.244   0.055  1.00  0.00           H  
HETATM   49  H   UNL     1       1.247   2.390  -1.636  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.290  -3.036   1.035  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.633  -2.232  -1.607  1.00  0.00           H  
HETATM   52  H   UNL     1       1.279   3.425   1.214  1.00  0.00           H  
HETATM   53  H   UNL     1       2.708  -0.728   0.699  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.048   5.209   0.025  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.167   4.177  -1.419  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.115   1.421   1.429  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.177   2.421   0.410  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.715   4.394   0.185  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.799   3.610   1.495  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.251   1.728  -0.081  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.296   2.493  -1.303  1.00  0.00           H  
HETATM   62  H   UNL     1       4.230   0.768  -2.808  1.00  0.00           H  
HETATM   63  H   UNL     1       4.772   1.673  -1.370  1.00  0.00           H  
HETATM   64  H   UNL     1      -6.243   0.759  -1.321  1.00  0.00           H  
HETATM   65  H   UNL     1       5.542  -1.003  -2.220  1.00  0.00           H  
HETATM   66  H   UNL     1       4.552  -2.364  -0.652  1.00  0.00           H  
HETATM   67  H   UNL     1       7.404  -0.301  -1.103  1.00  0.00           H  
HETATM   68  H   UNL     1       6.524   1.184  -0.656  1.00  0.00           H  
HETATM   69  H   UNL     1       7.293  -1.039   1.040  1.00  0.00           H  
HETATM   70  H   UNL     1       4.467  -0.555   1.668  1.00  0.00           H  
HETATM   71  H   UNL     1       6.345   0.499   2.798  1.00  0.00           H  
HETATM   72  H   UNL     1       5.720   1.538   1.495  1.00  0.00           H  
HETATM   73  H   UNL     1      -2.629   5.129  -0.632  1.00  0.00           H  
HETATM   74  H   UNL     1      -7.551  -0.115   0.698  1.00  0.00           H  
HETATM   75  H   UNL     1      -3.260  -4.272   1.035  1.00  0.00           H  
HETATM   76  H   UNL     1       2.402  -3.760  -1.717  1.00  0.00           H  
CONECT    1    7   12   20   37                                       
CONECT    2   29   38   39   40                                       
CONECT    3   28   41   42   43                                       
CONECT    4    5   12   36   44                                       
CONECT    5    6    6    4   45                                       
CONECT    6    9    5    5   46                                       
CONECT    7    8    1   47   48                                       
CONECT    8   11   11    7   49                                       
CONECT    9   10   10    6   50                                       
CONECT   10   14    9    9   51                                       
CONECT   11   13    8    8   52                                       
CONECT   12    1    4   25   53                                       
CONECT   13   23   11   54   55                                       
CONECT   14   19   19   32   10                                       
CONECT   15   17   21   56   57                                       
CONECT   16   17   30   58   59                                       
CONECT   17   15   16   60   61                                       
CONECT   18   31   33   33   19                                       
CONECT   19   18   22   14   14                                       
CONECT   20    1   24   62   63                                       
CONECT   21   31   15   22   64                                       
CONECT   22   21   19   34   34                                       
CONECT   23   30   35   35   13                                       
CONECT   24   20   25   26   65                                       
CONECT   25   12   24   28   66                                       
CONECT   26   24   27   67   68                                       
CONECT   27   28   26   29   69                                       
CONECT   28   25    3   27   70                                       
CONECT   29   27    2   71   72                                       
CONECT   30   16   23   73                                            
CONECT   31   21   18   74                                            
CONECT   32   14   75                                                 
CONECT   33   18   18                                                 
CONECT   34   22   22                                                 
CONECT   35   23   23                                                 
CONECT   36    4   76                                                 
CONECT   37    1                                                      
CONECT   38    2                                                      
CONECT   39    2                                                      
CONECT   40    2                                                      
CONECT   41    3                                                      
CONECT   42    3                                                      
CONECT   43    3                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
CONECT   48    7                                                      
CONECT   49    8                                                      
CONECT   50    9                                                      
CONECT   51   10                                                      
CONECT   52   11                                                      
CONECT   53   12                                                      
CONECT   54   13                                                      
CONECT   55   13                                                      
CONECT   56   15                                                      
CONECT   57   15                                                      
CONECT   58   16                                                      
CONECT   59   16                                                      
CONECT   60   17                                                      
CONECT   61   17                                                      
CONECT   62   20                                                      
CONECT   63   20                                                      
CONECT   64   21                                                      
CONECT   65   24                                                      
CONECT   66   25                                                      
CONECT   67   26                                                      
CONECT   68   26                                                      
CONECT   69   27                                                      
CONECT   70   28                                                      
CONECT   71   29                                                      
CONECT   72   29                                                      
CONECT   73   30                                                      
CONECT   74   31                                                      
CONECT   75   32                                                      
CONECT   76   36                                                      
MASTER        0    0    0    0    0    0    0    0   76    0   76    0
END
