COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -5.447  -0.822   0.195  1.00  0.00           O  
HETATM    2  C   UNL     1      -4.340  -1.209  -0.118  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.060  -2.652  -0.510  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.750  -3.087   0.154  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.514  -4.574  -0.123  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.853  -2.867   1.665  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.571  -2.279  -0.394  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.879  -0.808  -0.279  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.176  -0.316  -0.153  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.065   1.122  -0.074  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.136   2.170   0.080  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.458   3.481   0.503  1.00  0.00           C  
HETATM   13  N   UNL     1      -2.316   3.749  -0.381  1.00  0.00           N  
HETATM   14  C   UNL     1      -1.872   5.144  -0.259  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.205   2.818  -0.124  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.745   1.409  -0.164  1.00  0.00           C  
HETATM   17  N   UNL     1      -1.041   0.240  -0.278  1.00  0.00           N  
HETATM   18  C   UNL     1       0.349   0.152  -0.394  1.00  0.00           C  
HETATM   19  C   UNL     1       1.158   0.541   0.669  1.00  0.00           C  
HETATM   20  C   UNL     1       0.917  -0.330  -1.569  1.00  0.00           C  
HETATM   21  C   UNL     1       2.285  -0.417  -1.683  1.00  0.00           C  
HETATM   22  C   UNL     1       2.924  -0.936  -2.944  1.00  0.00           C  
HETATM   23  C   UNL     1       4.245  -0.212  -3.194  1.00  0.00           C  
HETATM   24  N   UNL     1       5.092  -0.243  -2.005  1.00  0.00           N  
HETATM   25  C   UNL     1       4.567  -0.124  -0.769  1.00  0.00           C  
HETATM   26  O   UNL     1       5.289  -0.101   0.208  1.00  0.00           O  
HETATM   27  C   UNL     1       3.101  -0.021  -0.618  1.00  0.00           C  
HETATM   28  C   UNL     1       2.530   0.457   0.560  1.00  0.00           C  
HETATM   29  C   UNL     1       3.408   0.878   1.710  1.00  0.00           C  
HETATM   30  C   UNL     1       3.759  -0.345   2.559  1.00  0.00           C  
HETATM   31  C   UNL     1       4.749   0.060   3.653  1.00  0.00           C  
HETATM   32  C   UNL     1       2.487  -0.901   3.204  1.00  0.00           C  
HETATM   33  H   UNL     1      -4.875  -3.290  -0.167  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.966  -2.727  -1.593  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.593  -4.892   0.366  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.351  -5.153   0.266  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.429  -4.734  -1.197  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.010  -1.808   1.868  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.691  -3.442   2.059  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.930  -3.196   2.144  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.673  -2.508   0.181  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.409  -2.535  -1.441  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.653   2.311  -0.869  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.848   1.859   0.845  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.174   4.300   0.430  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.109   3.394   1.532  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.505   5.322   0.752  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.072   5.335  -0.975  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.709   5.811  -0.465  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.440   2.939  -0.891  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.777   3.020   0.858  1.00  0.00           H  
HETATM   52  H   UNL     1       0.711   0.911   1.580  1.00  0.00           H  
HETATM   53  H   UNL     1       0.285  -0.635  -2.389  1.00  0.00           H  
HETATM   54  H   UNL     1       3.111  -2.005  -2.842  1.00  0.00           H  
HETATM   55  H   UNL     1       2.253  -0.766  -3.786  1.00  0.00           H  
HETATM   56  H   UNL     1       4.768  -0.696  -4.018  1.00  0.00           H  
HETATM   57  H   UNL     1       4.040   0.825  -3.460  1.00  0.00           H  
HETATM   58  H   UNL     1       6.051  -0.350  -2.106  1.00  0.00           H  
HETATM   59  H   UNL     1       4.323   1.327   1.323  1.00  0.00           H  
HETATM   60  H   UNL     1       2.878   1.607   2.324  1.00  0.00           H  
HETATM   61  H   UNL     1       4.209  -1.110   1.926  1.00  0.00           H  
HETATM   62  H   UNL     1       4.299   0.825   4.286  1.00  0.00           H  
HETATM   63  H   UNL     1       4.999  -0.812   4.258  1.00  0.00           H  
HETATM   64  H   UNL     1       5.655   0.456   3.194  1.00  0.00           H  
HETATM   65  H   UNL     1       2.737  -1.772   3.808  1.00  0.00           H  
HETATM   66  H   UNL     1       2.037  -0.136   3.837  1.00  0.00           H  
HETATM   67  H   UNL     1       1.781  -1.189   2.424  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1    9                                       
CONECT    3    4    2   33   34                                       
CONECT    4    6    5    7    3                                       
CONECT    5    4   35   36   37                                       
CONECT    6    4   38   39   40                                       
CONECT    7    4    8   41   42                                       
CONECT    8    7   17    9    9                                       
CONECT    9    8    8    2   10                                       
CONECT   10    9   16   16   11                                       
CONECT   11   10   12   43   44                                       
CONECT   12   11   13   45   46                                       
CONECT   13   15   12   14                                            
CONECT   14   13   47   48   49                                       
CONECT   15   16   13   50   51                                       
CONECT   16   17   10   10   15                                       
CONECT   17   18    8   16                                            
CONECT   18   19   17   20   20                                       
CONECT   19   28   28   18   52                                       
CONECT   20   18   18   21   53                                       
CONECT   21   27   27   20   22                                       
CONECT   22   21   23   54   55                                       
CONECT   23   24   22   56   57                                       
CONECT   24   25   23   58                                            
CONECT   25   26   26   27   24                                       
CONECT   26   25   25                                                 
CONECT   27   28   25   21   21                                       
CONECT   28   29   19   19   27                                       
CONECT   29   30   28   59   60                                       
CONECT   30   31   29   32   61                                       
CONECT   31   30   62   63   64                                       
CONECT   32   30   65   66   67                                       
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   12                                                      
CONECT   47   14                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   15                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   22                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   29                                                      
CONECT   60   29                                                      
CONECT   61   30                                                      
CONECT   62   31                                                      
CONECT   63   31                                                      
CONECT   64   31                                                      
CONECT   65   32                                                      
CONECT   66   32                                                      
CONECT   67   32                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
