COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.261  -4.793   0.690  1.00  0.00           C  
HETATM    2  O   UNL     1      -4.313  -3.828   0.624  1.00  0.00           O  
HETATM    3  C   UNL     1      -3.948  -2.530   0.450  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.919  -1.543   0.377  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.551  -0.211   0.199  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.205   0.130   0.095  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.231  -0.864   0.168  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.608  -2.196   0.352  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.800  -0.508   0.057  1.00  0.00           C  
HETATM   10  O   UNL     1      -0.473   0.652  -0.098  1.00  0.00           O  
HETATM   11  N   UNL     1       0.141  -1.470   0.129  1.00  0.00           N  
HETATM   12  C   UNL     1       1.488  -1.147  -0.073  1.00  0.00           C  
HETATM   13  C   UNL     1       1.982   0.076   0.363  1.00  0.00           C  
HETATM   14  C   UNL     1       3.310   0.394   0.164  1.00  0.00           C  
HETATM   15  C   UNL     1       4.154  -0.509  -0.471  1.00  0.00           C  
HETATM   16  C   UNL     1       3.660  -1.732  -0.906  1.00  0.00           C  
HETATM   17  C   UNL     1       2.333  -2.052  -0.703  1.00  0.00           C  
HETATM   18  N   UNL     1       5.501  -0.186  -0.673  1.00  0.00           N  
HETATM   19  C   UNL     1       6.165   0.541   0.248  1.00  0.00           C  
HETATM   20  O   UNL     1       5.574   0.986   1.212  1.00  0.00           O  
HETATM   21  C   UNL     1       7.615   0.796   0.085  1.00  0.00           C  
HETATM   22  C   UNL     1       8.297   1.542   1.043  1.00  0.00           C  
HETATM   23  C   UNL     1       9.654   1.768   0.880  1.00  0.00           C  
HETATM   24  C   UNL     1      10.283   1.239  -0.236  1.00  0.00           C  
HETATM   25  C   UNL     1       9.542   0.505  -1.150  1.00  0.00           C  
HETATM   26  N   UNL     1       8.255   0.306  -0.970  1.00  0.00           N  
HETATM   27  C   UNL     1      -5.591   0.843   0.121  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.677   1.813   1.076  1.00  0.00           C  
HETATM   29  N   UNL     1      -6.646   2.770   0.977  1.00  0.00           N  
HETATM   30  C   UNL     1      -7.519   2.777  -0.043  1.00  0.00           C  
HETATM   31  O   UNL     1      -8.365   3.649  -0.090  1.00  0.00           O  
HETATM   32  N   UNL     1      -7.484   1.847  -1.014  1.00  0.00           N  
HETATM   33  C   UNL     1      -6.552   0.872  -0.989  1.00  0.00           C  
HETATM   34  O   UNL     1      -6.511   0.030  -1.867  1.00  0.00           O  
HETATM   35  H   UNL     1      -3.688  -5.786   0.830  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.689  -4.771  -0.237  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.605  -4.559   1.528  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.964  -1.807   0.458  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.917   1.161  -0.048  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.854  -2.967   0.410  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.115  -2.386   0.319  1.00  0.00           H  
HETATM   42  H   UNL     1       1.327   0.778   0.856  1.00  0.00           H  
HETATM   43  H   UNL     1       3.694   1.345   0.502  1.00  0.00           H  
HETATM   44  H   UNL     1       4.315  -2.434  -1.400  1.00  0.00           H  
HETATM   45  H   UNL     1       1.949  -3.003  -1.041  1.00  0.00           H  
HETATM   46  H   UNL     1       5.956  -0.485  -1.475  1.00  0.00           H  
HETATM   47  H   UNL     1       7.774   1.940   1.901  1.00  0.00           H  
HETATM   48  H   UNL     1      10.210   2.343   1.606  1.00  0.00           H  
HETATM   49  H   UNL     1      11.340   1.397  -0.393  1.00  0.00           H  
HETATM   50  H   UNL     1      10.028   0.092  -2.020  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.984   1.824   1.904  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.704   3.458   1.657  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.130   1.880  -1.737  1.00  0.00           H  
CONECT    1    2   35   36   37                                       
CONECT    2    3    1                                                 
CONECT    3    8    8    4    2                                       
CONECT    4    5    5    3   38                                       
CONECT    5    6   27    4    4                                       
CONECT    6    7    7    5   39                                       
CONECT    7    9    6    6    8                                       
CONECT    8    7    3    3   40                                       
CONECT    9   10   10   11    7                                       
CONECT   10    9    9                                                 
CONECT   11   12    9   41                                            
CONECT   12   17   17   13   11                                       
CONECT   13   14   14   12   42                                       
CONECT   14   15   13   13   43                                       
CONECT   15   18   16   16   14                                       
CONECT   16   15   15   17   44                                       
CONECT   17   16   12   12   45                                       
CONECT   18   19   15   46                                            
CONECT   19   21   18   20   20                                       
CONECT   20   19   19                                                 
CONECT   21   22   22   26   19                                       
CONECT   22   23   21   21   47                                       
CONECT   23   24   24   22   48                                       
CONECT   24   23   23   25   49                                       
CONECT   25   24   26   26   50                                       
CONECT   26   25   25   21                                            
CONECT   27   28   28    5   33                                       
CONECT   28   29   27   27   51                                       
CONECT   29   28   30   52                                            
CONECT   30   29   31   31   32                                       
CONECT   31   30   30                                                 
CONECT   32   30   33   53                                            
CONECT   33   27   32   34   34                                       
CONECT   34   33   33                                                 
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    4                                                      
CONECT   39    6                                                      
CONECT   40    8                                                      
CONECT   41   11                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
CONECT   53   32                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
