COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.849  -0.695  -1.965  1.00  0.00           C  
HETATM    2  O   UNL     1       7.339   0.041  -0.852  1.00  0.00           O  
HETATM    3  C   UNL     1       6.009  -0.071  -0.595  1.00  0.00           C  
HETATM    4  C   UNL     1       5.215  -0.879  -1.396  1.00  0.00           C  
HETATM    5  C   UNL     1       3.865  -0.996  -1.139  1.00  0.00           C  
HETATM    6  C   UNL     1       3.294  -0.301  -0.072  1.00  0.00           C  
HETATM    7  C   UNL     1       4.093   0.512   0.735  1.00  0.00           C  
HETATM    8  C   UNL     1       5.447   0.621   0.475  1.00  0.00           C  
HETATM    9  O   UNL     1       6.229   1.407   1.263  1.00  0.00           O  
HETATM   10  C   UNL     1       5.586   2.087   2.342  1.00  0.00           C  
HETATM   11  C   UNL     1       1.847  -0.426   0.205  1.00  0.00           C  
HETATM   12  C   UNL     1       0.971  -1.184  -0.500  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.334  -0.990   0.141  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.114  -0.127   1.176  1.00  0.00           C  
HETATM   15  O   UNL     1       1.184   0.191   1.200  1.00  0.00           O  
HETATM   16  C   UNL     1      -1.617  -1.600  -0.251  1.00  0.00           C  
HETATM   17  O   UNL     1      -1.666  -2.356  -1.202  1.00  0.00           O  
HETATM   18  N   UNL     1      -2.737  -1.319   0.444  1.00  0.00           N  
HETATM   19  CA  UNL     1      -4.013  -1.925   0.054  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.165  -1.038   0.528  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.113   0.283  -0.196  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.790   0.441  -1.393  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.748   1.650  -2.064  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.030   2.707  -1.543  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.345   2.555  -0.336  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.396   1.333   0.339  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.599   3.648   0.210  1.00  0.00           C  
HETATM   28  N   UNL     1      -3.006   4.515   0.643  1.00  0.00           N  
HETATM   29  C   UNL     1      -4.137  -3.309   0.695  1.00  0.00           C  
HETATM   30  O   UNL     1      -4.203  -3.171   2.116  1.00  0.00           O  
HETATM   31  HA  UNL     1      -4.052  -2.023  -1.031  1.00  0.00           H  
HETATM   32  H   UNL     1       8.921  -0.517  -2.059  1.00  0.00           H  
HETATM   33  H   UNL     1       7.670  -1.759  -1.810  1.00  0.00           H  
HETATM   34  H   UNL     1       7.347  -0.371  -2.877  1.00  0.00           H  
HETATM   35  H   UNL     1       5.655  -1.417  -2.222  1.00  0.00           H  
HETATM   36  H   UNL     1       3.249  -1.625  -1.764  1.00  0.00           H  
HETATM   37  H   UNL     1       3.655   1.051   1.562  1.00  0.00           H  
HETATM   38  H   UNL     1       6.321   2.678   2.889  1.00  0.00           H  
HETATM   39  H   UNL     1       4.812   2.746   1.948  1.00  0.00           H  
HETATM   40  H   UNL     1       5.134   1.357   3.014  1.00  0.00           H  
HETATM   41  H   UNL     1       1.190  -1.804  -1.357  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.864   0.235   1.864  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.699  -0.716   1.203  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.114  -1.531   0.317  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.075  -0.868   1.601  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.353  -0.383  -1.805  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.278   1.766  -2.998  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.998   3.650  -2.068  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.869   1.208   1.273  1.00  0.00           H  
HETATM   50  H1  UNL     1      -5.043  -3.796   0.335  1.00  0.00           H  
HETATM   51  H2  UNL     1      -3.270  -3.912   0.428  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.283  -4.011   2.589  1.00  0.00           H  
CONECT    1    2   32   33   34                                       
CONECT    2    1    3                                                 
CONECT    3    2    4    4    8                                       
CONECT    4    3    3    5   35                                       
CONECT    5    4    6    6   36                                       
CONECT    6    5    5   11    7                                       
CONECT    7    6    8    8   37                                       
CONECT    8    3    7    7    9                                       
CONECT    9    8   10                                                 
CONECT   10    9   38   39   40                                       
CONECT   11    6   12   12   15                                       
CONECT   12   11   11   13   41                                       
CONECT   13   12   16   14   14                                       
CONECT   14   13   13   15   42                                       
CONECT   15   11   14                                                 
CONECT   16   13   17   17   18                                       
CONECT   17   16   16                                                 
CONECT   18   16   19   43                                            
CONECT   19   18   31   20   29                                       
CONECT   20   19   21   44   45                                       
CONECT   21   20   26   26   22                                       
CONECT   22   21   23   23   46                                       
CONECT   23   22   22   24   47                                       
CONECT   24   23   25   25   48                                       
CONECT   25   24   24   27   26                                       
CONECT   26   21   21   25   49                                       
CONECT   27   25   28   28   28                                       
CONECT   28   27   27   27                                            
CONECT   29   19   30   50   51                                       
CONECT   30   29   52                                                 
CONECT   31   19                                                      
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    7                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   12                                                      
CONECT   42   14                                                      
CONECT   43   18                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   26                                                      
CONECT   50   29                                                      
CONECT   51   29                                                      
CONECT   52   30                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
