COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.313   1.250  -0.197  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.334   1.809  -1.022  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.112   1.168  -1.121  1.00  0.00           C  
HETATM    4  N   UNL     1      -4.908   0.054  -0.438  1.00  0.00           N  
HETATM    5  N   UNL     1      -7.038   0.126   0.461  1.00  0.00           N  
HETATM    6  C   UNL     1      -5.855  -0.455   0.337  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.608  -4.464   1.182  1.00  0.00           C  
HETATM    8  C   UNL     1       7.753   4.837   1.059  1.00  0.00           C  
HETATM    9  C   UNL     1       5.574   4.138   1.849  1.00  0.00           C  
HETATM   10  C   UNL     1       9.161   0.075   1.712  1.00  0.00           C  
HETATM   11  C   UNL     1     -10.835   1.993   0.879  1.00  0.00           C  
HETATM   12  C   UNL     1       9.492  -1.263   1.824  1.00  0.00           C  
HETATM   13  C   UNL     1     -11.045   3.158   0.164  1.00  0.00           C  
HETATM   14  C   UNL     1       8.240   0.468   0.757  1.00  0.00           C  
HETATM   15  C   UNL     1      -9.616   1.346   0.777  1.00  0.00           C  
HETATM   16  C   UNL     1       2.571   0.801  -0.686  1.00  0.00           C  
HETATM   17  C   UNL     1       3.394  -0.978  -2.072  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.147  -4.348   0.749  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.987  -3.636   0.511  1.00  0.00           C  
HETATM   20  C   UNL     1       1.451   0.055  -0.381  1.00  0.00           C  
HETATM   21  C   UNL     1       2.276  -1.732  -1.779  1.00  0.00           C  
HETATM   22  C   UNL     1       8.071  -1.843   0.105  1.00  0.00           C  
HETATM   23  C   UNL     1      -8.927   3.079  -0.740  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.223  -1.578   0.627  1.00  0.00           C  
HETATM   25  C   UNL     1       6.638   2.952   0.026  1.00  0.00           C  
HETATM   26  C   UNL     1       5.906   1.644   0.332  1.00  0.00           C  
HETATM   27  C   UNL     1       4.756   1.111  -1.866  1.00  0.00           C  
HETATM   28  C   UNL     1       0.100  -2.026  -0.604  1.00  0.00           C  
HETATM   29  C   UNL     1       6.699  -0.151  -1.113  1.00  0.00           C  
HETATM   30  C   UNL     1       3.539   0.288  -1.532  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.345  -3.684   0.922  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.022  -2.249   0.449  1.00  0.00           C  
HETATM   33  C   UNL     1       1.296  -1.220  -0.927  1.00  0.00           C  
HETATM   34  C   UNL     1       7.680  -0.515  -0.068  1.00  0.00           C  
HETATM   35  C   UNL     1      -8.638   1.902  -0.052  1.00  0.00           C  
HETATM   36  C   UNL     1      -4.388  -2.296   0.855  1.00  0.00           C  
HETATM   37  N   UNL     1       8.944  -2.168   1.036  1.00  0.00           N  
HETATM   38  N   UNL     1     -10.102   3.659  -0.611  1.00  0.00           N  
HETATM   39  N   UNL     1      -0.845  -1.529   0.219  1.00  0.00           N  
HETATM   40  N   UNL     1      -5.601  -1.624   1.035  1.00  0.00           N  
HETATM   41  N   UNL     1       6.852   3.697   1.274  1.00  0.00           N  
HETATM   42  N   UNL     1       5.813   0.839  -0.889  1.00  0.00           N  
HETATM   43  O   UNL     1      -0.033  -3.136  -1.080  1.00  0.00           O  
HETATM   44  O   UNL     1       6.692  -0.744  -2.174  1.00  0.00           O  
HETATM   45  H   UNL     1      -6.527   2.720  -1.569  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.333   1.574  -1.750  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.737  -4.598   2.256  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.462  -3.919   0.778  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.538  -5.439   0.699  1.00  0.00           H  
HETATM   50  H   UNL     1       7.894   5.371   1.998  1.00  0.00           H  
HETATM   51  H   UNL     1       8.716   4.476   0.698  1.00  0.00           H  
HETATM   52  H   UNL     1       7.318   5.510   0.320  1.00  0.00           H  
HETATM   53  H   UNL     1       5.092   4.841   1.169  1.00  0.00           H  
HETATM   54  H   UNL     1       4.925   3.275   1.998  1.00  0.00           H  
HETATM   55  H   UNL     1       5.755   4.626   2.807  1.00  0.00           H  
HETATM   56  H   UNL     1       9.613   0.806   2.366  1.00  0.00           H  
HETATM   57  H   UNL     1     -11.613   1.595   1.514  1.00  0.00           H  
HETATM   58  H   UNL     1      10.211  -1.572   2.568  1.00  0.00           H  
HETATM   59  H   UNL     1     -11.995   3.665   0.241  1.00  0.00           H  
HETATM   60  H   UNL     1       7.959   1.505   0.651  1.00  0.00           H  
HETATM   61  H   UNL     1      -9.425   0.435   1.325  1.00  0.00           H  
HETATM   62  H   UNL     1       2.690   1.790  -0.269  1.00  0.00           H  
HETATM   63  H   UNL     1       4.153  -1.372  -2.731  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.117  -5.427   0.798  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.052  -4.159   0.374  1.00  0.00           H  
HETATM   66  H   UNL     1       0.697   0.456   0.279  1.00  0.00           H  
HETATM   67  H   UNL     1       2.164  -2.720  -2.201  1.00  0.00           H  
HETATM   68  H   UNL     1       7.648  -2.613  -0.524  1.00  0.00           H  
HETATM   69  H   UNL     1      -8.180   3.520  -1.384  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.251  -0.499   0.588  1.00  0.00           H  
HETATM   71  H   UNL     1       7.601   2.731  -0.434  1.00  0.00           H  
HETATM   72  H   UNL     1       6.038   3.553  -0.658  1.00  0.00           H  
HETATM   73  H   UNL     1       6.457   1.089   1.092  1.00  0.00           H  
HETATM   74  H   UNL     1       4.904   1.865   0.699  1.00  0.00           H  
HETATM   75  H   UNL     1       5.108   0.850  -2.864  1.00  0.00           H  
HETATM   76  H   UNL     1       4.497   2.170  -1.837  1.00  0.00           H  
HETATM   77  H   UNL     1      -0.709  -0.672   0.652  1.00  0.00           H  
HETATM   78  H   UNL     1      -6.264  -1.976   1.649  1.00  0.00           H  
CONECT    1   35    2    2    5                                       
CONECT    2    1    1    3   45                                       
CONECT    3    2    4    4   46                                       
CONECT    4    3    3    6                                            
CONECT    5    1    6    6                                            
CONECT    6    5    5    4   40                                       
CONECT    7   31   47   48   49                                       
CONECT    8   41   50   51   52                                       
CONECT    9   41   53   54   55                                       
CONECT   10   12   14   14   56                                       
CONECT   11   13   13   15   57                                       
CONECT   12   37   37   10   58                                       
CONECT   13   11   11   38   59                                       
CONECT   14   10   10   34   60                                       
CONECT   15   11   35   35   61                                       
CONECT   16   20   20   30   62                                       
CONECT   17   21   30   30   63                                       
CONECT   18   31   31   19   64                                       
CONECT   19   32   32   18   65                                       
CONECT   20   33   16   16   66                                       
CONECT   21   33   33   17   67                                       
CONECT   22   37   34   34   68                                       
CONECT   23   38   38   35   69                                       
CONECT   24   36   36   32   70                                       
CONECT   25   41   26   71   72                                       
CONECT   26   42   25   73   74                                       
CONECT   27   30   42   75   76                                       
CONECT   28   43   43   39   33                                       
CONECT   29   34   44   44   42                                       
CONECT   30   17   17   16   27                                       
CONECT   31   36    7   18   18                                       
CONECT   32   24   39   19   19                                       
CONECT   33   28   21   21   20                                       
CONECT   34   22   22   14   29                                       
CONECT   35   15   15   23    1                                       
CONECT   36   40   24   24   31                                       
CONECT   37   12   12   22                                            
CONECT   38   13   23   23                                            
CONECT   39   32   28   77                                            
CONECT   40    6   36   78                                            
CONECT   41    8    9   25                                            
CONECT   42   29   27   26                                            
CONECT   43   28   28                                                 
CONECT   44   29   29                                                 
CONECT   45    2                                                      
CONECT   46    3                                                      
CONECT   47    7                                                      
CONECT   48    7                                                      
CONECT   49    7                                                      
CONECT   50    8                                                      
CONECT   51    8                                                      
CONECT   52    8                                                      
CONECT   53    9                                                      
CONECT   54    9                                                      
CONECT   55    9                                                      
CONECT   56   10                                                      
CONECT   57   11                                                      
CONECT   58   12                                                      
CONECT   59   13                                                      
CONECT   60   14                                                      
CONECT   61   15                                                      
CONECT   62   16                                                      
CONECT   63   17                                                      
CONECT   64   18                                                      
CONECT   65   19                                                      
CONECT   66   20                                                      
CONECT   67   21                                                      
CONECT   68   22                                                      
CONECT   69   23                                                      
CONECT   70   24                                                      
CONECT   71   25                                                      
CONECT   72   25                                                      
CONECT   73   26                                                      
CONECT   74   26                                                      
CONECT   75   27                                                      
CONECT   76   27                                                      
CONECT   77   39                                                      
CONECT   78   40                                                      
MASTER        0    0    0    0    0    0    0    0   78    0   78    0
END
