COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.921  -0.642  -0.173  1.00  0.00           C  
HETATM    2  C   UNL     1       3.488  -1.899  -0.395  1.00  0.00           C  
HETATM    3  C   UNL     1       2.684  -3.022  -0.380  1.00  0.00           C  
HETATM    4  N   UNL     1       5.574   1.832  -0.350  1.00  0.00           N  
HETATM    5  C   UNL     1       1.322  -2.860  -0.141  1.00  0.00           C  
HETATM    6  C   UNL     1       0.818  -1.567   0.075  1.00  0.00           C  
HETATM    7  N   UNL     1       1.623  -0.513   0.058  1.00  0.00           N  
HETATM    8  C   UNL     1      -0.629  -1.745   0.292  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.861  -3.075   0.192  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.628  -0.683   0.566  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.389   0.263   1.562  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.321   1.248   1.812  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.492   1.299   1.076  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.734   0.364   0.086  1.00  0.00           C  
HETATM   15  C   UNL     1       4.480   4.100   0.063  1.00  0.00           C  
HETATM   16  N   UNL     1       4.464   2.642  -0.085  1.00  0.00           N  
HETATM   17  C   UNL     1       5.175   0.589  -0.413  1.00  0.00           C  
HETATM   18  C   UNL     1       3.785   0.564  -0.188  1.00  0.00           C  
HETATM   19  C   UNL     1       3.377   1.851   0.011  1.00  0.00           C  
HETATM   20  O   UNL     1       0.287  -3.721  -0.067  1.00  0.00           O  
HETATM   21  C   UNL     1      -2.806  -0.623  -0.177  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.012   0.426  -0.710  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.191   1.741  -1.486  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.676   1.682  -1.089  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.237   0.841   0.122  1.00  0.00           C  
HETATM   26  H   UNL     1       4.548  -1.992  -0.578  1.00  0.00           H  
HETATM   27  H   UNL     1       3.102  -4.003  -0.550  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.827  -3.546   0.301  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.476   0.223   2.137  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.137   1.981   2.583  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.219   2.073   1.275  1.00  0.00           H  
HETATM   32  H   UNL     1       4.319   4.565  -0.910  1.00  0.00           H  
HETATM   33  H   UNL     1       3.688   4.405   0.747  1.00  0.00           H  
HETATM   34  H   UNL     1       5.445   4.414   0.461  1.00  0.00           H  
HETATM   35  H   UNL     1       5.802  -0.269  -0.605  1.00  0.00           H  
HETATM   36  H   UNL     1       2.367   2.177   0.211  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.994  -1.350  -0.953  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.176  -0.465  -1.317  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.655   2.583  -1.048  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.022   1.642  -2.559  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.094   2.651  -0.819  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.296   1.136  -1.800  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.912   0.016   0.347  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.987   1.437   0.999  1.00  0.00           H  
CONECT    1    7    7    2   18                                       
CONECT    2    3    3    1   26                                       
CONECT    3    5    2    2   27                                       
CONECT    4   17   17   16                                            
CONECT    5   20    6    6    3                                       
CONECT    6    8    5    5    7                                       
CONECT    7    6    1    1                                            
CONECT    8    9    9   10    6                                       
CONECT    9    8    8   20   28                                       
CONECT   10   11    8   21   21                                       
CONECT   11   12   12   10   29                                       
CONECT   12   11   11   13   30                                       
CONECT   13   12   14   14   31                                       
CONECT   14   13   13   21   22                                       
CONECT   15   16   32   33   34                                       
CONECT   16   19   15    4                                            
CONECT   17   18    4    4   35                                       
CONECT   18    1   19   19   17                                       
CONECT   19   18   18   16   36                                       
CONECT   20    9    5                                                 
CONECT   21   10   10   14   37                                       
CONECT   22   14   23   25   38                                       
CONECT   23   22   24   39   40                                       
CONECT   24   23   25   41   42                                       
CONECT   25   22   24   43   44                                       
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    9                                                      
CONECT   29   11                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   15                                                      
CONECT   33   15                                                      
CONECT   34   15                                                      
CONECT   35   17                                                      
CONECT   36   19                                                      
CONECT   37   21                                                      
CONECT   38   22                                                      
CONECT   39   23                                                      
CONECT   40   23                                                      
CONECT   41   24                                                      
CONECT   42   24                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
