COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       9.181  -1.062   1.800  1.00  0.00           N  
HETATM    2  C   UNL     1       8.118  -1.486   1.044  1.00  0.00           C  
HETATM    3  N   UNL     1       8.190  -2.696   0.421  1.00  0.00           N  
HETATM    4  N   UNL     1       7.062  -0.711   0.937  1.00  0.00           N  
HETATM    5  C   UNL     1       6.002  -1.083   0.210  1.00  0.00           C  
HETATM    6  C   UNL     1       6.012  -2.317  -0.450  1.00  0.00           C  
HETATM    7  C   UNL     1       7.155  -3.141  -0.326  1.00  0.00           C  
HETATM    8  O   UNL     1       7.207  -4.224  -0.883  1.00  0.00           O  
HETATM    9  N   UNL     1       4.829  -2.435  -1.101  1.00  0.00           N  
HETATM   10  C   UNL     1       4.111  -1.372  -0.885  1.00  0.00           C  
HETATM   11  N   UNL     1       4.794  -0.508  -0.080  1.00  0.00           N  
HETATM   12  C   UNL     1       4.321   0.797   0.389  1.00  0.00           C  
HETATM   13  C   UNL     1       4.802   1.916  -0.561  1.00  0.00           C  
HETATM   14  O   UNL     1       5.967   2.558  -0.041  1.00  0.00           O  
HETATM   15  C   UNL     1       3.613   2.905  -0.606  1.00  0.00           C  
HETATM   16  O   UNL     1       4.007   4.186  -0.111  1.00  0.00           O  
HETATM   17  C   UNL     1       2.558   2.266   0.325  1.00  0.00           C  
HETATM   18  O   UNL     1       2.879   0.858   0.336  1.00  0.00           O  
HETATM   19  C   UNL     1       1.150   2.488  -0.230  1.00  0.00           C  
HETATM   20  O   UNL     1       0.190   1.928   0.668  1.00  0.00           O  
HETATM   21  P   UNL     1      -1.261   2.195   0.025  1.00  0.00           P  
HETATM   22  O   UNL     1      -1.300   1.647  -1.350  1.00  0.00           O  
HETATM   23  O   UNL     1      -1.544   3.780  -0.021  1.00  0.00           O  
HETATM   24  O   UNL     1      -2.387   1.475   0.922  1.00  0.00           O  
HETATM   25  P   UNL     1      -3.691   1.314  -0.009  1.00  0.00           P  
HETATM   26  O   UNL     1      -4.416   2.742  -0.168  1.00  0.00           O  
HETATM   27  O   UNL     1      -3.287   0.814  -1.342  1.00  0.00           O  
HETATM   28  O   UNL     1      -4.709   0.267   0.670  1.00  0.00           O  
HETATM   29  C   UNL     1      -5.783   0.078  -0.253  1.00  0.00           C  
HETATM   30  O   UNL     1      -5.470  -1.002  -1.130  1.00  0.00           O  
HETATM   31  C   UNL     1      -5.118  -2.125  -0.324  1.00  0.00           C  
HETATM   32  C   UNL     1      -4.592  -3.249  -1.218  1.00  0.00           C  
HETATM   33  O   UNL     1      -3.374  -2.833  -1.839  1.00  0.00           O  
HETATM   34  C   UNL     1      -7.067  -0.237   0.518  1.00  0.00           C  
HETATM   35  O   UNL     1      -8.138  -0.457  -0.403  1.00  0.00           O  
HETATM   36  C   UNL     1      -6.849  -1.498   1.360  1.00  0.00           C  
HETATM   37  O   UNL     1      -8.080  -1.891   1.969  1.00  0.00           O  
HETATM   38  C   UNL     1      -6.348  -2.619   0.442  1.00  0.00           C  
HETATM   39  O   UNL     1      -5.996  -3.760   1.226  1.00  0.00           O  
HETATM   40  H   UNL     1       9.147  -0.201   2.247  1.00  0.00           H  
HETATM   41  H   UNL     1       9.966  -1.625   1.892  1.00  0.00           H  
HETATM   42  H   UNL     1       8.984  -3.244   0.520  1.00  0.00           H  
HETATM   43  H   UNL     1       3.122  -1.200  -1.283  1.00  0.00           H  
HETATM   44  H   UNL     1       4.672   0.985   1.404  1.00  0.00           H  
HETATM   45  H   UNL     1       5.000   1.513  -1.554  1.00  0.00           H  
HETATM   46  H   UNL     1       6.181   3.283  -0.644  1.00  0.00           H  
HETATM   47  H   UNL     1       3.224   2.991  -1.620  1.00  0.00           H  
HETATM   48  H   UNL     1       4.663   4.535  -0.730  1.00  0.00           H  
HETATM   49  H   UNL     1       2.639   2.681   1.330  1.00  0.00           H  
HETATM   50  H   UNL     1       0.966   3.556  -0.339  1.00  0.00           H  
HETATM   51  H   UNL     1       1.063   2.003  -1.203  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.510   4.096   0.892  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.663   3.031   0.721  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.925   0.988  -0.836  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.343  -1.833   0.385  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.406  -4.137  -0.614  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.331  -3.479  -1.985  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.077  -3.568  -2.393  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.313   0.599   1.171  1.00  0.00           H  
HETATM   60  H   UNL     1      -8.241   0.359  -0.911  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.106  -1.298   2.132  1.00  0.00           H  
HETATM   62  H   UNL     1      -8.358  -1.159   2.536  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.133  -2.890  -0.265  1.00  0.00           H  
HETATM   64  H   UNL     1      -6.797  -4.038   1.690  1.00  0.00           H  
CONECT    1    2   40   41                                            
CONECT    2    1    3    4    4                                       
CONECT    3    2    7   42                                            
CONECT    4    2    2    5                                            
CONECT    5    4    6    6   11                                       
CONECT    6    5    5    7    9                                       
CONECT    7    3    6    8    8                                       
CONECT    8    7    7                                                 
CONECT    9    6   10   10                                            
CONECT   10    9    9   11   43                                       
CONECT   11    5   10   12                                            
CONECT   12   11   13   18   44                                       
CONECT   13   12   14   15   45                                       
CONECT   14   13   46                                                 
CONECT   15   13   16   17   47                                       
CONECT   16   15   48                                                 
CONECT   17   15   18   19   49                                       
CONECT   18   12   17                                                 
CONECT   19   17   20   50   51                                       
CONECT   20   19   21                                                 
CONECT   21   20   22   22   23                                       
CONECT   21   24                                                      
CONECT   22   21   21                                                 
CONECT   23   21   52                                                 
CONECT   24   21   25                                                 
CONECT   25   24   26   27   27                                       
CONECT   25   28                                                      
CONECT   26   25   53                                                 
CONECT   27   25   25                                                 
CONECT   28   25   29                                                 
CONECT   29   28   30   34   54                                       
CONECT   30   29   31                                                 
CONECT   31   30   32   38   55                                       
CONECT   32   31   33   56   57                                       
CONECT   33   32   58                                                 
CONECT   34   29   35   36   59                                       
CONECT   35   34   60                                                 
CONECT   36   34   37   38   61                                       
CONECT   37   36   62                                                 
CONECT   38   31   36   39   63                                       
CONECT   39   38   64                                                 
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    3                                                      
CONECT   43   10                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   23                                                      
CONECT   53   26                                                      
CONECT   54   29                                                      
CONECT   55   31                                                      
CONECT   56   32                                                      
CONECT   57   32                                                      
CONECT   58   33                                                      
CONECT   59   34                                                      
CONECT   60   35                                                      
CONECT   61   36                                                      
CONECT   62   37                                                      
CONECT   63   38                                                      
CONECT   64   39                                                      
MASTER        0    0    0    0    0    0    0    0   64    0   64    0
END
