COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       0.322  -3.252   0.502  1.00  0.00           O  
HETATM    2  N   UNL     1       5.051   0.402   0.546  1.00  0.00           N  
HETATM    3  C   UNL     1       5.272   0.687  -0.751  1.00  0.00           C  
HETATM    4  O   UNL     1       4.346   0.634  -1.543  1.00  0.00           O  
HETATM    5  N   UNL     1       6.483   1.036  -1.181  1.00  0.00           N  
HETATM    6  C   UNL     1       7.508   1.101  -0.341  1.00  0.00           C  
HETATM    7  N   UNL     1       8.755   1.457  -0.798  1.00  0.00           N  
HETATM    8  C   UNL     1       7.310   0.803   1.023  1.00  0.00           C  
HETATM    9  C   UNL     1       6.072   0.455   1.446  1.00  0.00           C  
HETATM   10  C   UNL     1       3.706   0.028   0.990  1.00  0.00           C  
HETATM   11  C   UNL     1       2.782   1.198   0.811  1.00  0.00           C  
HETATM   12  C   UNL     1       1.552   1.059   0.401  1.00  0.00           C  
HETATM   13  C   UNL     1       0.989  -0.301   0.081  1.00  0.00           C  
HETATM   14  C   UNL     1       1.919  -1.376   0.652  1.00  0.00           C  
HETATM   15  O   UNL     1       3.257  -1.093   0.232  1.00  0.00           O  
HETATM   16  O   UNL     1       2.242  -3.354  -0.586  1.00  0.00           O  
HETATM   17  C   UNL     1       1.506  -2.733   0.144  1.00  0.00           C  
HETATM   18  N   UNL     1      -0.341  -0.435   0.682  1.00  0.00           N  
HETATM   19  C   UNL     1      -1.426   0.022   0.025  1.00  0.00           C  
HETATM   20  O   UNL     1      -1.301   0.543  -1.063  1.00  0.00           O  
HETATM   21  C   UNL     1      -2.793  -0.116   0.643  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.841   0.478  -0.301  1.00  0.00           C  
HETATM   23  N   UNL     1      -3.892  -0.315  -1.537  1.00  0.00           N  
HETATM   24  C   UNL     1      -5.212   0.452   0.378  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.236   1.157  -0.513  1.00  0.00           C  
HETATM   26  N   UNL     1      -7.549   1.132   0.137  1.00  0.00           N  
HETATM   27  C   UNL     1      -7.943   2.222   1.033  1.00  0.00           C  
HETATM   28  C   UNL     1      -8.411   0.086  -0.094  1.00  0.00           C  
HETATM   29  N   UNL     1      -9.578   0.064   0.484  1.00  0.00           N  
HETATM   30  N   UNL     1      -8.041  -0.937  -0.935  1.00  0.00           N  
HETATM   31  H   UNL     1       0.057  -4.123   0.176  1.00  0.00           H  
HETATM   32  H   UNL     1       9.503   1.504  -0.181  1.00  0.00           H  
HETATM   33  H   UNL     1       8.888   1.661  -1.737  1.00  0.00           H  
HETATM   34  H   UNL     1       8.134   0.851   1.720  1.00  0.00           H  
HETATM   35  H   UNL     1       5.896   0.223   2.486  1.00  0.00           H  
HETATM   36  H   UNL     1       3.740  -0.244   2.045  1.00  0.00           H  
HETATM   37  H   UNL     1       3.150   2.190   1.028  1.00  0.00           H  
HETATM   38  H   UNL     1       0.928   1.933   0.289  1.00  0.00           H  
HETATM   39  H   UNL     1       0.914  -0.420  -1.000  1.00  0.00           H  
HETATM   40  H   UNL     1       1.867  -1.361   1.740  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.440  -0.852   1.552  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.818   0.417   1.594  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.012  -1.170   0.811  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.574   1.507  -0.540  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.949  -0.356  -1.894  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.142  -1.255  -1.269  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.152   0.964   1.338  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.519  -0.582   0.537  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.297   0.644  -1.473  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.929   2.191  -0.672  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.138   2.953   1.092  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.843   2.702   0.647  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.143   1.821   2.027  1.00  0.00           H  
HETATM   54  H   UNL     1     -10.186  -0.674   0.321  1.00  0.00           H  
HETATM   55  H   UNL     1      -8.649  -1.675  -1.098  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.171  -0.920  -1.366  1.00  0.00           H  
CONECT    1   17   31                                                 
CONECT    2    3    9   10                                            
CONECT    3    2    4    4    5                                       
CONECT    4    3    3                                                 
CONECT    5    3    6    6                                            
CONECT    6    5    5    7    8                                       
CONECT    7    6   32   33                                            
CONECT    8    6    9    9   34                                       
CONECT    9    2    8    8   35                                       
CONECT   10    2   11   15   36                                       
CONECT   11   10   12   12   37                                       
CONECT   12   11   11   13   38                                       
CONECT   13   12   14   18   39                                       
CONECT   14   13   15   17   40                                       
CONECT   15   10   14                                                 
CONECT   16   17   17                                                 
CONECT   17    1   14   16   16                                       
CONECT   18   13   19   41                                            
CONECT   19   18   20   20   21                                       
CONECT   20   19   19                                                 
CONECT   21   19   22   42   43                                       
CONECT   22   21   23   24   44                                       
CONECT   23   22   45   46                                            
CONECT   24   22   25   47   48                                       
CONECT   25   24   26   49   50                                       
CONECT   26   25   27   28                                            
CONECT   27   26   51   52   53                                       
CONECT   28   26   29   29   30                                       
CONECT   29   28   28   54                                            
CONECT   30   28   55   56                                            
CONECT   31    1                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   18                                                      
CONECT   42   21                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   27                                                      
CONECT   54   29                                                      
CONECT   55   30                                                      
CONECT   56   30                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
