COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -7.248   0.942   0.920  1.00  0.00           N  
HETATM    2  N   UNL     1       1.361  -1.668  -0.273  1.00  0.00           N  
HETATM    3  C   UNL     1      -5.196   0.974  -0.238  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.821  -0.192   0.451  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.504  -0.825   0.211  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.822  -1.441   1.261  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.595  -2.029   1.031  1.00  0.00           C  
HETATM    8  C   UNL     1       0.298  -2.655  -0.480  1.00  0.00           C  
HETATM    9  C   UNL     1       5.060  -1.389  -0.396  1.00  0.00           C  
HETATM   10  C   UNL     1       5.731   0.840   0.164  1.00  0.00           C  
HETATM   11  C   UNL     1       6.635   3.021  -0.596  1.00  0.00           C  
HETATM   12  C   UNL     1       4.408   1.207   0.333  1.00  0.00           C  
HETATM   13  C   UNL     1       3.403   0.282   0.139  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.716  -1.405  -1.283  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.854  -0.150   1.541  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.461   1.537   0.028  1.00  0.00           C  
HETATM   17  C   UNL     1       2.651  -2.022  -0.436  1.00  0.00           C  
HETATM   18  C   UNL     1       3.723  -1.026  -0.227  1.00  0.00           C  
HETATM   19  C   UNL     1       6.056  -0.455  -0.199  1.00  0.00           C  
HETATM   20  C   UNL     1       6.824   1.856   0.377  1.00  0.00           C  
HETATM   21  C   UNL     1       6.763   2.377   1.815  1.00  0.00           C  
HETATM   22  C   UNL     1       8.184   1.201   0.130  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.446   2.814  -1.513  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.943  -0.813  -1.066  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.572   1.830  -1.242  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.041  -2.010  -0.236  1.00  0.00           C  
HETATM   27  N   UNL     1      -6.580   2.649  -0.761  1.00  0.00           N  
HETATM   28  N   UNL     1      -5.680  -0.712   1.325  1.00  0.00           N  
HETATM   29  O   UNL     1       2.933  -3.161  -0.756  1.00  0.00           O  
HETATM   30  H   UNL     1       1.136  -0.760  -0.018  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.253  -1.456   2.251  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.066  -2.506   1.843  1.00  0.00           H  
HETATM   33  H   UNL     1       0.342  -3.026  -1.504  1.00  0.00           H  
HETATM   34  H   UNL     1       0.433  -3.485   0.213  1.00  0.00           H  
HETATM   35  H   UNL     1       5.315  -2.401  -0.675  1.00  0.00           H  
HETATM   36  H   UNL     1       5.666   3.488  -0.419  1.00  0.00           H  
HETATM   37  H   UNL     1       7.425   3.756  -0.442  1.00  0.00           H  
HETATM   38  H   UNL     1       6.678   2.650  -1.620  1.00  0.00           H  
HETATM   39  H   UNL     1       4.161   2.220   0.616  1.00  0.00           H  
HETATM   40  H   UNL     1       2.370   0.570   0.271  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.278  -1.393  -2.270  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.521  -0.605   2.259  1.00  0.00           H  
HETATM   43  H   UNL     1       7.091  -0.735  -0.329  1.00  0.00           H  
HETATM   44  H   UNL     1       6.898   1.546   2.508  1.00  0.00           H  
HETATM   45  H   UNL     1       7.554   3.111   1.969  1.00  0.00           H  
HETATM   46  H   UNL     1       5.794   2.843   1.991  1.00  0.00           H  
HETATM   47  H   UNL     1       8.228   0.830  -0.894  1.00  0.00           H  
HETATM   48  H   UNL     1       8.975   1.935   0.284  1.00  0.00           H  
HETATM   49  H   UNL     1       8.319   0.370   0.823  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.281   3.614  -2.219  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.468  -0.342  -1.883  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.594   1.699  -1.681  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.353   3.235  -0.784  1.00  0.00           H  
CONECT    1   15   15   16                                            
CONECT    2    8   17   30                                            
CONECT    3   16   16    4   25                                       
CONECT    4   28   28    3    5                                       
CONECT    5    4   24   24    6                                       
CONECT    6    5    7    7   31                                       
CONECT    7    6    6   26   32                                       
CONECT    8   26    2   33   34                                       
CONECT    9   18   18   19   35                                       
CONECT   10   19   19   12   20                                       
CONECT   11   20   36   37   38                                       
CONECT   12   13   13   10   39                                       
CONECT   13   18   12   12   40                                       
CONECT   14   24   26   26   41                                       
CONECT   15    1    1   28   42                                       
CONECT   16    1   27    3    3                                       
CONECT   17   29   29    2   18                                       
CONECT   18   17    9    9   13                                       
CONECT   19    9   10   10   43                                       
CONECT   20   10   22   21   11                                       
CONECT   21   20   44   45   46                                       
CONECT   22   20   47   48   49                                       
CONECT   23   27   25   25   50                                       
CONECT   24    5    5   14   51                                       
CONECT   25   23   23    3   52                                       
CONECT   26   14   14    7    8                                       
CONECT   27   16   23   53                                            
CONECT   28   15    4    4                                            
CONECT   29   17   17                                                 
CONECT   30    2                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   19                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   25                                                      
CONECT   53   27                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
