COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.211   3.629   1.377  1.00  0.00           O  
HETATM    2  C   UNL     1       6.621  -3.099  -0.784  1.00  0.00           C  
HETATM    3  C   UNL     1       5.138  -1.615   0.335  1.00  0.00           C  
HETATM    4  N   UNL     1       0.976   1.044  -0.111  1.00  0.00           N  
HETATM    5  C   UNL     1       4.831  -1.076  -0.906  1.00  0.00           C  
HETATM    6  C   UNL     1       3.922  -0.040  -1.003  1.00  0.00           C  
HETATM    7  O   UNL     1      -3.402   0.301   0.481  1.00  0.00           O  
HETATM    8  C   UNL     1       3.319   0.460   0.136  1.00  0.00           C  
HETATM    9  O   UNL     1      -3.658  -0.980  -1.313  1.00  0.00           O  
HETATM   10  C   UNL     1       3.623  -0.075   1.374  1.00  0.00           C  
HETATM   11  O   UNL     1       6.036  -2.630   0.433  1.00  0.00           O  
HETATM   12  C   UNL     1       4.531  -1.111   1.476  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.880  -0.799  -0.132  1.00  0.00           C  
HETATM   14  N   UNL     1      -4.603  -1.698   0.563  1.00  0.00           N  
HETATM   15  C   UNL     1      -5.123  -2.894  -0.104  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.048  -3.983  -0.109  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.358  -3.400   0.645  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.631   1.226  -0.330  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.790   2.650   0.218  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.783   3.578  -0.467  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.365   3.239   0.011  1.00  0.00           C  
HETATM   22  C   UNL     1       0.660   3.974  -0.854  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.166   1.752  -0.118  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.172   0.857  -0.272  1.00  0.00           C  
HETATM   25  N   UNL     1      -0.606  -0.343  -0.353  1.00  0.00           N  
HETATM   26  N   UNL     1       0.673  -0.203  -0.254  1.00  0.00           N  
HETATM   27  C   UNL     1       2.328   1.591   0.028  1.00  0.00           C  
HETATM   28  H   UNL     1      -0.344   4.574   1.534  1.00  0.00           H  
HETATM   29  H   UNL     1       5.837  -3.464  -1.447  1.00  0.00           H  
HETATM   30  H   UNL     1       7.155  -2.281  -1.268  1.00  0.00           H  
HETATM   31  H   UNL     1       7.317  -3.908  -0.564  1.00  0.00           H  
HETATM   32  H   UNL     1       5.302  -1.467  -1.796  1.00  0.00           H  
HETATM   33  H   UNL     1       3.683   0.380  -1.969  1.00  0.00           H  
HETATM   34  H   UNL     1       3.151   0.318   2.263  1.00  0.00           H  
HETATM   35  H   UNL     1       4.768  -1.529   2.444  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.781  -1.553   1.506  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.396  -2.648  -1.130  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.434  -4.872  -0.606  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.168  -3.622  -0.642  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.775  -4.229   0.917  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.123  -2.625   0.648  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.744  -4.290   0.148  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.085  -3.646   1.671  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.979   1.187  -1.362  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.802   3.004   0.020  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.610   2.648   1.293  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.844   3.447  -1.547  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.013   4.613  -0.213  1.00  0.00           H  
HETATM   49  H   UNL     1       1.659   3.819  -0.445  1.00  0.00           H  
HETATM   50  H   UNL     1       0.620   3.588  -1.872  1.00  0.00           H  
HETATM   51  H   UNL     1       0.432   5.040  -0.860  1.00  0.00           H  
HETATM   52  H   UNL     1       2.566   2.199  -0.844  1.00  0.00           H  
HETATM   53  H   UNL     1       2.381   2.207   0.926  1.00  0.00           H  
CONECT    1   21   28                                                 
CONECT    2   11   29   30   31                                       
CONECT    3   11    5    5   12                                       
CONECT    4   27   26   23                                            
CONECT    5    3    3    6   32                                       
CONECT    6    5    8    8   33                                       
CONECT    7   18   13                                                 
CONECT    8    6    6   10   27                                       
CONECT    9   13   13                                                 
CONECT   10   12   12    8   34                                       
CONECT   11    2    3                                                 
CONECT   12    3   10   10   35                                       
CONECT   13    7    9    9   14                                       
CONECT   14   13   15   36                                            
CONECT   15   16   14   17   37                                       
CONECT   16   15   38   39   40                                       
CONECT   17   15   41   42   43                                       
CONECT   18   24   19    7   44                                       
CONECT   19   20   18   45   46                                       
CONECT   20   21   19   47   48                                       
CONECT   21    1   22   23   20                                       
CONECT   22   21   49   50   51                                       
CONECT   23    4   21   24   24                                       
CONECT   24   23   23   25   18                                       
CONECT   25   26   26   24                                            
CONECT   26    4   25   25                                            
CONECT   27    8    4   52   53                                       
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34   10                                                      
CONECT   35   12                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   16                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   22                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   27                                                      
CONECT   53   27                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
