COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.232   0.367   1.242  1.00  0.00           N  
HETATM    2  C   UNL     1      -0.118   1.321   1.365  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.556   2.681   0.887  1.00  0.00           C  
HETATM    4  O   UNL     1      -1.480   3.242   1.426  1.00  0.00           O  
HETATM    5  C   UNL     1       1.032   0.813   0.496  1.00  0.00           C  
HETATM    6  C   UNL     1       1.281  -0.652   0.740  1.00  0.00           C  
HETATM    7  C   UNL     1       2.521  -1.166   0.368  1.00  0.00           C  
HETATM    8  C   UNL     1       0.342  -1.487   1.306  1.00  0.00           C  
HETATM    9  C   UNL     1       4.249  -4.400   0.420  1.00  0.00           C  
HETATM   10  C   UNL     1       2.811  -2.511   0.559  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.015  -0.991   1.753  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.407   0.728   0.688  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.490  -0.299   0.482  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.786   0.397   0.152  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.934   0.088   0.857  1.00  0.00           C  
HETATM   16  C   UNL     1      -7.123   0.726   0.555  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.162   1.673  -0.452  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.014   1.981  -1.156  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.824   1.347  -0.850  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.107  -1.212  -0.654  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.170  -2.583  -0.490  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.823  -3.421  -1.534  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.415  -2.887  -2.742  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.353  -1.516  -2.906  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.699  -0.678  -1.862  1.00  0.00           C  
HETATM   26  C   UNL     1       0.632  -2.831   1.492  1.00  0.00           C  
HETATM   27  C   UNL     1       1.858  -3.345   1.122  1.00  0.00           C  
HETATM   28  C   UNL     1       4.355   0.308   0.710  1.00  0.00           C  
HETATM   29  C   UNL     1       5.309   1.168  -0.078  1.00  0.00           C  
HETATM   30  C   UNL     1       4.989   2.485  -0.350  1.00  0.00           C  
HETATM   31  C   UNL     1       5.864   3.274  -1.073  1.00  0.00           C  
HETATM   32  C   UNL     1       7.059   2.746  -1.524  1.00  0.00           C  
HETATM   33  C   UNL     1       7.380   1.429  -1.251  1.00  0.00           C  
HETATM   34  C   UNL     1       6.508   0.642  -0.523  1.00  0.00           C  
HETATM   35  O   UNL     1       4.023  -3.007   0.194  1.00  0.00           O  
HETATM   36  O   UNL     1      -2.591   1.880   0.355  1.00  0.00           O  
HETATM   37  O   UNL     1       3.454  -0.346  -0.185  1.00  0.00           O  
HETATM   38  O   UNL     1       0.080   3.270  -0.138  1.00  0.00           O  
HETATM   39  H   UNL     1       0.204   1.381   2.404  1.00  0.00           H  
HETATM   40  H   UNL     1       0.783   0.964  -0.554  1.00  0.00           H  
HETATM   41  H   UNL     1       1.936   1.374   0.734  1.00  0.00           H  
HETATM   42  H   UNL     1       5.252  -4.665   0.086  1.00  0.00           H  
HETATM   43  H   UNL     1       4.153  -4.616   1.484  1.00  0.00           H  
HETATM   44  H   UNL     1       3.515  -4.983  -0.137  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.061  -0.980   2.842  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.789  -1.653   1.365  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.614  -0.885   1.393  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.903  -0.651   1.643  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.020   0.485   1.105  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.091   2.171  -0.688  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.045   2.721  -1.943  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.927   1.588  -1.401  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.489  -3.000   0.453  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.872  -4.492  -1.406  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.144  -3.541  -3.557  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.034  -1.099  -3.850  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.654   0.393  -1.992  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.110  -3.482   1.930  1.00  0.00           H  
HETATM   59  H   UNL     1       2.074  -4.393   1.270  1.00  0.00           H  
HETATM   60  H   UNL     1       4.918  -0.439   1.270  1.00  0.00           H  
HETATM   61  H   UNL     1       3.791   0.932   1.403  1.00  0.00           H  
HETATM   62  H   UNL     1       4.055   2.898   0.002  1.00  0.00           H  
HETATM   63  H   UNL     1       5.614   4.303  -1.285  1.00  0.00           H  
HETATM   64  H   UNL     1       7.741   3.362  -2.092  1.00  0.00           H  
HETATM   65  H   UNL     1       8.314   1.017  -1.604  1.00  0.00           H  
HETATM   66  H   UNL     1       6.758  -0.387  -0.311  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.237   4.143  -0.408  1.00  0.00           H  
CONECT    1    2   12   11                                            
CONECT    2    3    5    1   39                                       
CONECT    3    4    4    2   38                                       
CONECT    4    3    3                                                 
CONECT    5    2    6   40   41                                       
CONECT    6    5    7    7    8                                       
CONECT    7   37    6    6   10                                       
CONECT    8    6   11   26   26                                       
CONECT    9   35   42   43   44                                       
CONECT   10    7   35   27   27                                       
CONECT   11    1    8   45   46                                       
CONECT   12   13    1   36   36                                       
CONECT   13   20   14   12   47                                       
CONECT   14   19   13   15   15                                       
CONECT   15   14   14   16   48                                       
CONECT   16   17   17   15   49                                       
CONECT   17   18   16   16   50                                       
CONECT   18   19   19   17   51                                       
CONECT   19   18   18   14   52                                       
CONECT   20   21   21   25   13                                       
CONECT   21   22   20   20   53                                       
CONECT   22   23   23   21   54                                       
CONECT   23   22   22   24   55                                       
CONECT   24   23   25   25   56                                       
CONECT   25   24   24   20   57                                       
CONECT   26    8    8   27   58                                       
CONECT   27   10   10   26   59                                       
CONECT   28   29   37   60   61                                       
CONECT   29   34   34   30   28                                       
CONECT   30   31   31   29   62                                       
CONECT   31   32   30   30   63                                       
CONECT   32   33   33   31   64                                       
CONECT   33   32   32   34   65                                       
CONECT   34   33   29   29   66                                       
CONECT   35   10    9                                                 
CONECT   36   12   12                                                 
CONECT   37   28    7                                                 
CONECT   38    3   67                                                 
CONECT   39    2                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   11                                                      
CONECT   46   11                                                      
CONECT   47   13                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   25                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   28                                                      
CONECT   61   28                                                      
CONECT   62   30                                                      
CONECT   63   31                                                      
CONECT   64   32                                                      
CONECT   65   33                                                      
CONECT   66   34                                                      
CONECT   67   38                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
