COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.492   0.508  -0.103  1.00  0.00           C  
HETATM    2  C   UNL     1       2.763  -0.863  -0.112  1.00  0.00           C  
HETATM    3  C   UNL     1       4.059  -1.306  -0.172  1.00  0.00           C  
HETATM    4  C   UNL     1       5.109  -0.386  -0.225  1.00  0.00           C  
HETATM    5  C   UNL     1       4.840   0.984  -0.216  1.00  0.00           C  
HETATM    6  C   UNL     1       3.544   1.428  -0.155  1.00  0.00           C  
HETATM    7  O   UNL     1       0.000   0.206   0.005  1.00  0.00           O  
HETATM    8  C   UNL     1       1.098   0.985  -0.044  1.00  0.00           C  
HETATM    9  C   UNL     1       0.700   2.290  -0.029  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.700   2.290   0.032  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.098   0.986   0.052  1.00  0.00           C  
HETATM   12  C   UNL     1       6.507  -0.864  -0.289  1.00  0.00           C  
HETATM   13  N   UNL     1       6.797  -2.067  -0.897  1.00  0.00           N  
HETATM   14  N   UNL     1       7.465  -0.148   0.229  1.00  0.00           N1+
HETATM   15  C   UNL     1       8.850  -0.622   0.165  1.00  0.00           C  
HETATM   16  C   UNL     1       9.770   0.398   0.840  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.492   0.509   0.113  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.763  -0.863   0.127  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.060  -1.305   0.184  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.110  -0.385   0.226  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.841   0.985   0.212  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.544   1.429   0.162  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.508  -0.863   0.287  1.00  0.00           C  
HETATM   24  N   UNL     1      -6.801  -2.063   0.899  1.00  0.00           N  
HETATM   25  N   UNL     1      -7.464  -0.149  -0.239  1.00  0.00           N1+
HETATM   26  C   UNL     1      -8.849  -0.623  -0.180  1.00  0.00           C  
HETATM   27  C   UNL     1      -9.765   0.394  -0.865  1.00  0.00           C  
HETATM   28  H   UNL     1       1.951  -1.574  -0.071  1.00  0.00           H  
HETATM   29  H   UNL     1       4.268  -2.365  -0.179  1.00  0.00           H  
HETATM   30  H   UNL     1       5.653   1.694  -0.256  1.00  0.00           H  
HETATM   31  H   UNL     1       3.336   2.488  -0.149  1.00  0.00           H  
HETATM   32  H   UNL     1       1.342   3.158  -0.058  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.342   3.158   0.058  1.00  0.00           H  
HETATM   34  H   UNL     1       6.084  -2.600  -1.282  1.00  0.00           H  
HETATM   35  H   UNL     1       8.931  -1.580   0.678  1.00  0.00           H  
HETATM   36  H   UNL     1       9.474   0.518   1.883  1.00  0.00           H  
HETATM   37  H   UNL     1      10.800   0.045   0.793  1.00  0.00           H  
HETATM   38  H   UNL     1       9.689   1.356   0.327  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.951  -1.574   0.093  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.269  -2.364   0.195  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.654   1.696   0.245  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.336   2.489   0.155  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.090  -2.594   1.290  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.718  -2.376   0.938  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.927  -1.583  -0.689  1.00  0.00           H  
HETATM   46  H   UNL     1      -9.149  -0.738   0.862  1.00  0.00           H  
HETATM   47  H   UNL     1      -9.687   1.354  -0.355  1.00  0.00           H  
HETATM   48  H   UNL     1      -9.465   0.509  -1.906  1.00  0.00           H  
HETATM   49  H   UNL     1     -10.796   0.041  -0.820  1.00  0.00           H  
HETATM   50  H   UNL     1       7.714  -2.381  -0.939  1.00  0.00           H  
HETATM   51  H   UNL     1       7.262   0.698   0.656  1.00  0.00           H  
HETATM   52  H   UNL     1       9.146  -0.743  -0.878  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.258   0.695  -0.670  1.00  0.00           H  
CONECT    1    2    2    6    8                                       
CONECT    2    1    1    3   28                                       
CONECT    3    2    4    4   29                                       
CONECT    4    3    3    5   12                                       
CONECT    5    4    6    6   30                                       
CONECT    6    1    5    5   31                                       
CONECT    7    8   11                                                 
CONECT    8    1    7    9    9                                       
CONECT    9    8    8   10   32                                       
CONECT   10    9   11   11   33                                       
CONECT   11    7   10   10   17                                       
CONECT   12    4   13   14   14                                       
CONECT   13   12   34   50                                            
CONECT   14   12   12   15   51                                       
CONECT   15   14   16   35   52                                       
CONECT   16   15   36   37   38                                       
CONECT   17   11   18   18   22                                       
CONECT   18   17   17   19   39                                       
CONECT   19   18   20   20   40                                       
CONECT   20   19   19   21   23                                       
CONECT   21   20   22   22   41                                       
CONECT   22   17   21   21   42                                       
CONECT   23   20   24   25   25                                       
CONECT   24   23   43   44                                            
CONECT   25   23   23   26   53                                       
CONECT   26   25   27   45   46                                       
CONECT   27   26   47   48   49                                       
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   13                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   24                                                      
CONECT   44   24                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
CONECT   47   27                                                      
CONECT   48   27                                                      
CONECT   49   27                                                      
CONECT   50   13                                                      
CONECT   51   14                                                      
CONECT   52   15                                                      
CONECT   53   25                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
