COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.192  -1.142  -0.334  1.00  0.00           C  
HETATM    2  C   UNL     1       4.916   0.719   1.283  1.00  0.00           C  
HETATM    3  C   UNL     1       6.278   0.535   1.390  1.00  0.00           C  
HETATM    4  C   UNL     1       2.718   0.171   0.242  1.00  0.00           C  
HETATM    5  C   UNL     1       0.838   1.612  -0.147  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.022   0.309  -0.047  1.00  0.00           C  
HETATM    7  C   UNL     1       4.183  -0.025   0.360  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.643   0.330  -0.049  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.127   0.613  -0.832  1.00  0.00           C  
HETATM   10  C   UNL     1       3.925  -1.005  -2.754  1.00  0.00           C  
HETATM   11  C   UNL     1       4.040  -1.776  -1.438  1.00  0.00           C  
HETATM   12  C   UNL     1       4.830  -0.962  -0.446  1.00  0.00           C  
HETATM   13  C   UNL     1       6.920  -0.395   0.583  1.00  0.00           C  
HETATM   14  C   UNL     1       1.854  -0.916   0.426  1.00  0.00           C  
HETATM   15  C   UNL     1       0.504  -0.749   0.327  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.020   0.510   0.040  1.00  0.00           C  
HETATM   17  C   UNL     1       2.212   1.432  -0.044  1.00  0.00           C  
HETATM   18  N   UNL     1       0.026   2.685  -0.409  1.00  0.00           N  
HETATM   19  N   UNL     1      -1.212   2.344  -0.398  1.00  0.00           N  
HETATM   20  C   UNL     1      -1.368   1.064  -0.140  1.00  0.00           C  
HETATM   21  O   UNL     1      -2.644  -0.861   0.199  1.00  0.00           O  
HETATM   22  N   UNL     1      -3.809   0.979  -0.239  1.00  0.00           N  
HETATM   23  C   UNL     1      -5.141  -0.668   0.938  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.364  -1.299   1.094  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.418  -0.942   0.273  1.00  0.00           C  
HETATM   26  N   UNL     1      -7.273  -0.012  -0.651  1.00  0.00           N  
HETATM   27  C   UNL     1      -8.752  -1.625   0.437  1.00  0.00           C  
HETATM   28  O   UNL     1       8.262  -0.575   0.691  1.00  0.00           O  
HETATM   29  H   UNL     1       6.693  -1.867  -0.958  1.00  0.00           H  
HETATM   30  H   UNL     1       4.418   1.445   1.909  1.00  0.00           H  
HETATM   31  H   UNL     1       6.847   1.114   2.102  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.046   1.370  -1.599  1.00  0.00           H  
HETATM   33  H   UNL     1       4.921  -0.738  -3.107  1.00  0.00           H  
HETATM   34  H   UNL     1       3.431  -1.629  -3.499  1.00  0.00           H  
HETATM   35  H   UNL     1       3.341  -0.099  -2.595  1.00  0.00           H  
HETATM   36  H   UNL     1       3.043  -1.966  -1.040  1.00  0.00           H  
HETATM   37  H   UNL     1       4.547  -2.724  -1.615  1.00  0.00           H  
HETATM   38  H   UNL     1       2.260  -1.892   0.648  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.157  -1.591   0.469  1.00  0.00           H  
HETATM   40  H   UNL     1       2.882   2.268  -0.181  1.00  0.00           H  
HETATM   41  H   UNL     1       0.345   3.585  -0.580  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.807   1.911  -0.510  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.301  -0.927   1.564  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.493  -2.062   1.847  1.00  0.00           H  
HETATM   45  H   UNL     1      -9.357  -1.071   1.155  1.00  0.00           H  
HETATM   46  H   UNL     1      -9.264  -1.655  -0.524  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.597  -2.641   0.799  1.00  0.00           H  
HETATM   48  H   UNL     1       8.518  -1.250   1.334  1.00  0.00           H  
CONECT    1   13   12   12   29                                       
CONECT    2    3    7    7   30                                       
CONECT    3   13   13    2   31                                       
CONECT    4   14    7   17   17                                       
CONECT    5   16   16   17   18                                       
CONECT    6    9   22   23   23                                       
CONECT    7    2    2   12    4                                       
CONECT    8   21   21   20   22                                       
CONECT    9   26   26    6   32                                       
CONECT   10   11   33   34   35                                       
CONECT   11   12   10   36   37                                       
CONECT   12    1    1    7   11                                       
CONECT   13   28    3    3    1                                       
CONECT   14   15   15    4   38                                       
CONECT   15   14   14   16   39                                       
CONECT   16   15    5    5   20                                       
CONECT   17    4    4    5   40                                       
CONECT   18    5   19   41                                            
CONECT   19   20   20   18                                            
CONECT   20   16    8   19   19                                       
CONECT   21    8    8                                                 
CONECT   22    8    6   42                                            
CONECT   23    6    6   24   43                                       
CONECT   24   25   25   23   44                                       
CONECT   25   26   27   24   24                                       
CONECT   26    9    9   25                                            
CONECT   27   25   45   46   47                                       
CONECT   28   13   48                                                 
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   22                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   27                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
CONECT   48   28                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
