COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       5.264  -0.035  -0.141  1.00  0.00           N1+
HETATM    2  C   UNL     1       5.321  -1.413   0.360  1.00  0.00           C  
HETATM    3  C   UNL     1       6.760  -1.760   0.748  1.00  0.00           C  
HETATM    4  C   UNL     1       7.662  -1.624  -0.483  1.00  0.00           C  
HETATM    5  C   UNL     1       7.537  -0.204  -1.040  1.00  0.00           C  
HETATM    6  C   UNL     1       6.070   0.085  -1.362  1.00  0.00           C  
HETATM    7  C   UNL     1       5.790   0.878   0.883  1.00  0.00           C  
HETATM    8  C   UNL     1       3.870   0.318  -0.439  1.00  0.00           C  
HETATM    9  C   UNL     1       3.030   0.196   0.834  1.00  0.00           C  
HETATM   10  C   UNL     1       1.599   0.558   0.528  1.00  0.00           C  
HETATM   11  C   UNL     1       0.711  -0.422   0.125  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.601  -0.095  -0.156  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.028   1.221  -0.033  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.134   2.203   0.372  1.00  0.00           C  
HETATM   15  C   UNL     1       1.176   1.868   0.656  1.00  0.00           C  
HETATM   16  N   UNL     1      -2.357   1.557  -0.316  1.00  0.00           N  
HETATM   17  C   UNL     1      -3.344   0.678  -0.055  1.00  0.00           C  
HETATM   18  O   UNL     1      -3.094  -0.363   0.517  1.00  0.00           O  
HETATM   19  C   UNL     1      -4.759   0.987  -0.472  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.676  -0.166  -0.059  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.112   0.148  -0.483  1.00  0.00           C  
HETATM   22  C   UNL     1      -8.016  -0.987  -0.077  1.00  0.00           C  
HETATM   23  O   UNL     1      -9.329  -0.930  -0.348  1.00  0.00           O  
HETATM   24  O   UNL     1      -7.558  -1.949   0.494  1.00  0.00           O  
HETATM   25  H   UNL     1       4.676  -1.509   1.233  1.00  0.00           H  
HETATM   26  H   UNL     1       4.981  -2.096  -0.419  1.00  0.00           H  
HETATM   27  H   UNL     1       6.801  -2.785   1.117  1.00  0.00           H  
HETATM   28  H   UNL     1       7.102  -1.078   1.526  1.00  0.00           H  
HETATM   29  H   UNL     1       7.352  -2.342  -1.242  1.00  0.00           H  
HETATM   30  H   UNL     1       8.697  -1.815  -0.199  1.00  0.00           H  
HETATM   31  H   UNL     1       8.133  -0.116  -1.949  1.00  0.00           H  
HETATM   32  H   UNL     1       7.895   0.511  -0.299  1.00  0.00           H  
HETATM   33  H   UNL     1       5.713  -0.629  -2.104  1.00  0.00           H  
HETATM   34  H   UNL     1       5.977   1.096  -1.760  1.00  0.00           H  
HETATM   35  H   UNL     1       5.742   1.903   0.515  1.00  0.00           H  
HETATM   36  H   UNL     1       5.193   0.790   1.790  1.00  0.00           H  
HETATM   37  H   UNL     1       6.826   0.619   1.103  1.00  0.00           H  
HETATM   38  H   UNL     1       3.825   1.342  -0.808  1.00  0.00           H  
HETATM   39  H   UNL     1       3.478  -0.359  -1.199  1.00  0.00           H  
HETATM   40  H   UNL     1       3.074  -0.828   1.203  1.00  0.00           H  
HETATM   41  H   UNL     1       3.421   0.873   1.593  1.00  0.00           H  
HETATM   42  H   UNL     1       1.043  -1.445   0.029  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.294  -0.860  -0.471  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.463   3.227   0.469  1.00  0.00           H  
HETATM   45  H   UNL     1       1.872   2.631   0.971  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.567   2.422  -0.701  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.088   1.905   0.014  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.799   1.114  -1.554  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.347  -1.084  -0.545  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.636  -0.293   1.023  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.442   1.067   0.003  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.152   0.275  -1.565  1.00  0.00           H  
HETATM   53  H   UNL     1      -9.909  -1.658  -0.087  1.00  0.00           H  
CONECT    1    2    6    7    8                                       
CONECT    2    1    3   25   26                                       
CONECT    3    2    4   27   28                                       
CONECT    4    3    5   29   30                                       
CONECT    5    4    6   31   32                                       
CONECT    6    1    5   33   34                                       
CONECT    7    1   35   36   37                                       
CONECT    8    1    9   38   39                                       
CONECT    9    8   10   40   41                                       
CONECT   10    9   11   11   15                                       
CONECT   11   10   10   12   42                                       
CONECT   12   11   13   13   43                                       
CONECT   13   12   12   14   16                                       
CONECT   14   13   15   15   44                                       
CONECT   15   10   14   14   45                                       
CONECT   16   13   17   46                                            
CONECT   17   16   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   20   47   48                                       
CONECT   20   19   21   49   50                                       
CONECT   21   20   22   51   52                                       
CONECT   22   21   23   24   24                                       
CONECT   23   22   53                                                 
CONECT   24   22   22                                                 
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41    9                                                      
CONECT   42   11                                                      
CONECT   43   12                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   21                                                      
CONECT   52   21                                                      
CONECT   53   23                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
