COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.636   1.765   0.182  1.00  0.00           C  
HETATM    2  O   UNL     1       7.303   0.835  -0.220  1.00  0.00           O  
HETATM    3  C   UNL     1       7.310   3.022   0.668  1.00  0.00           C  
HETATM    4  N   UNL     1       5.291   1.673   0.194  1.00  0.00           N  
HETATM    5  C   UNL     1       4.636   0.451  -0.278  1.00  0.00           C  
HETATM    6  C   UNL     1       3.240   0.777  -0.744  1.00  0.00           C  
HETATM    7  O   UNL     1       2.833   1.918  -0.687  1.00  0.00           O  
HETATM    8  C   UNL     1       4.568  -0.565   0.863  1.00  0.00           C  
HETATM    9  C   UNL     1       5.986  -0.990   1.252  1.00  0.00           C  
HETATM   10  C   UNL     1       5.925  -1.909   2.474  1.00  0.00           C  
HETATM   11  C   UNL     1       6.633  -1.737   0.084  1.00  0.00           C  
HETATM   12  N   UNL     1       2.444  -0.199  -1.224  1.00  0.00           N  
HETATM   13  C   UNL     1       1.087   0.118  -1.676  1.00  0.00           C  
HETATM   14  C   UNL     1       0.819  -0.579  -3.011  1.00  0.00           C  
HETATM   15  P   UNL     1      -0.117  -0.461  -0.436  1.00  0.00           P  
HETATM   16  O   UNL     1       0.028  -2.053  -0.249  1.00  0.00           O  
HETATM   17  C   UNL     1      -1.806  -0.066  -0.999  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.808  -0.438   0.095  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.157   0.220  -0.204  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.122  -0.049   0.952  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.451   0.599   0.658  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.429  -0.106  -0.018  1.00  0.00           C  
HETATM   23  C   UNL     1      -8.648   0.489  -0.288  1.00  0.00           C  
HETATM   24  C   UNL     1      -8.888   1.788   0.118  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.910   2.493   0.794  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.693   1.896   1.069  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.977  -1.935   0.134  1.00  0.00           C  
HETATM   28  O   UNL     1      -3.814  -2.494   1.022  1.00  0.00           O  
HETATM   29  O   UNL     1      -2.359  -2.633  -0.635  1.00  0.00           O  
HETATM   30  O   UNL     1       0.142   0.213   0.856  1.00  0.00           O  
HETATM   31  H   UNL     1       6.554   3.740   0.986  1.00  0.00           H  
HETATM   32  H   UNL     1       7.962   2.783   1.508  1.00  0.00           H  
HETATM   33  H   UNL     1       7.902   3.452  -0.140  1.00  0.00           H  
HETATM   34  H   UNL     1       4.757   2.417   0.515  1.00  0.00           H  
HETATM   35  H   UNL     1       5.206   0.030  -1.107  1.00  0.00           H  
HETATM   36  H   UNL     1       4.076  -0.112   1.724  1.00  0.00           H  
HETATM   37  H   UNL     1       4.003  -1.439   0.539  1.00  0.00           H  
HETATM   38  H   UNL     1       6.577  -0.106   1.491  1.00  0.00           H  
HETATM   39  H   UNL     1       5.334  -2.793   2.235  1.00  0.00           H  
HETATM   40  H   UNL     1       6.935  -2.212   2.751  1.00  0.00           H  
HETATM   41  H   UNL     1       5.464  -1.378   3.306  1.00  0.00           H  
HETATM   42  H   UNL     1       6.041  -2.620  -0.155  1.00  0.00           H  
HETATM   43  H   UNL     1       6.676  -1.082  -0.786  1.00  0.00           H  
HETATM   44  H   UNL     1       7.643  -2.039   0.361  1.00  0.00           H  
HETATM   45  H   UNL     1       2.770  -1.112  -1.269  1.00  0.00           H  
HETATM   46  H   UNL     1       0.989   1.196  -1.803  1.00  0.00           H  
HETATM   47  H   UNL     1       0.918  -1.657  -2.885  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.190  -0.343  -3.348  1.00  0.00           H  
HETATM   49  H   UNL     1       1.540  -0.233  -3.753  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.129  -2.560  -1.058  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.029  -0.632  -1.904  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.878   1.000  -1.211  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.439  -0.089   1.060  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.019   1.295  -0.319  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.568  -0.195  -1.124  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.260  -1.124   1.068  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.712   0.366   1.873  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.241  -1.121  -0.336  1.00  0.00           H  
HETATM   59  H   UNL     1      -9.412  -0.062  -0.817  1.00  0.00           H  
HETATM   60  H   UNL     1      -9.840   2.253  -0.093  1.00  0.00           H  
HETATM   61  H   UNL     1      -8.097   3.508   1.111  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.930   2.445   1.601  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.889  -3.458   1.009  1.00  0.00           H  
CONECT    1    4    3    2    2                                       
CONECT    2    1    1                                                 
CONECT    3    1   31   32   33                                       
CONECT    4    5    1   34                                            
CONECT    5    6    8    4   35                                       
CONECT    6   12    5    7    7                                       
CONECT    7    6    6                                                 
CONECT    8    5    9   36   37                                       
CONECT    9    8   10   11   38                                       
CONECT   10    9   39   40   41                                       
CONECT   11    9   42   43   44                                       
CONECT   12   13    6   45                                            
CONECT   13   15   14   12   46                                       
CONECT   14   13   47   48   49                                       
CONECT   15   17   30   30   13                                       
CONECT   15   16                                                      
CONECT   16   15   50                                                 
CONECT   17   18   15   51   52                                       
CONECT   18   27   19   17   53                                       
CONECT   19   18   20   54   55                                       
CONECT   20   19   21   56   57                                       
CONECT   21   20   26   26   22                                       
CONECT   22   21   23   23   58                                       
CONECT   23   22   22   24   59                                       
CONECT   24   23   25   25   60                                       
CONECT   25   24   24   26   61                                       
CONECT   26   21   21   25   62                                       
CONECT   27   28   18   29   29                                       
CONECT   28   27   63                                                 
CONECT   29   27   27                                                 
CONECT   30   15   15                                                 
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   16                                                      
CONECT   51   17                                                      
CONECT   52   17                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   24                                                      
CONECT   61   25                                                      
CONECT   62   26                                                      
CONECT   63   28                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
