COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.762  -0.545  -2.057  1.00  0.00           O  
HETATM    2  C   UNL     1       4.424  -0.610  -0.872  1.00  0.00           C  
HETATM    3  C   UNL     1       5.719  -1.107  -0.825  1.00  0.00           C  
HETATM    4  C   UNL     1       6.389  -1.173   0.381  1.00  0.00           C  
HETATM    5  C   UNL     1       5.773  -0.738   1.540  1.00  0.00           C  
HETATM    6  C   UNL     1       4.485  -0.237   1.495  1.00  0.00           C  
HETATM    7  C   UNL     1       3.811  -0.170   0.292  1.00  0.00           C  
HETATM    8  C   UNL     1       2.407   0.376   0.244  1.00  0.00           C  
HETATM    9  N   UNL     1       1.452  -0.735   0.198  1.00  0.00           N  
HETATM   10  C   UNL     1       0.094  -0.478   0.149  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.835  -1.532   0.105  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.740  -2.884   0.095  1.00  0.00           N  
HETATM   13  C   UNL     1      -1.932  -3.402   0.046  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.202  -1.213   0.056  1.00  0.00           C  
HETATM   15  N   UNL     1      -2.870  -2.411   0.020  1.00  0.00           N  
HETATM   16  C   UNL     1      -4.322  -2.593  -0.035  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.692  -3.360  -1.307  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.784  -3.384   1.190  1.00  0.00           C  
HETATM   19  N   UNL     1      -2.570   0.065   0.059  1.00  0.00           N  
HETATM   20  C   UNL     1      -1.662   1.026   0.097  1.00  0.00           C  
HETATM   21  N   UNL     1      -0.361   0.771   0.143  1.00  0.00           N  
HETATM   22  N   UNL     1      -2.085   2.346   0.093  1.00  0.00           N  
HETATM   23  CA  UNL     1      -1.101   3.430   0.139  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.748   4.681   0.736  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.125   4.414   2.195  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.612   3.736  -1.278  1.00  0.00           C  
HETATM   27  O   UNL     1      -1.697   4.243  -2.057  1.00  0.00           O  
HETATM   28  H   UNL     1       3.294  -1.385  -2.162  1.00  0.00           H  
HETATM   29  H   UNL     1       6.200  -1.447  -1.730  1.00  0.00           H  
HETATM   30  H   UNL     1       7.395  -1.563   0.418  1.00  0.00           H  
HETATM   31  H   UNL     1       6.299  -0.789   2.482  1.00  0.00           H  
HETATM   32  H   UNL     1       4.006   0.102   2.402  1.00  0.00           H  
HETATM   33  H   UNL     1       2.287   0.994  -0.646  1.00  0.00           H  
HETATM   34  H   UNL     1       2.220   0.978   1.133  1.00  0.00           H  
HETATM   35  H   UNL     1       1.773  -1.650   0.201  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.148  -4.460   0.027  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.810  -1.619  -0.044  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.773  -3.496  -1.348  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.363  -2.797  -2.180  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.204  -4.335  -1.298  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.521  -2.837   2.096  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.865  -3.519   1.149  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.296  -4.358   1.199  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.032   2.551   0.059  1.00  0.00           H  
HETATM   45  HA  UNL     1      -0.256   3.128   0.758  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.645   4.932   0.169  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.045   5.512   0.689  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.586   5.305   2.620  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.829   3.582   2.242  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.228   4.163   2.761  1.00  0.00           H  
HETATM   51  H1  UNL     1       0.184   4.480  -1.235  1.00  0.00           H  
HETATM   52  H2  UNL     1      -0.231   2.823  -1.736  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.346   4.422  -2.941  1.00  0.00           H  
CONECT    1    2   28                                                 
CONECT    2    1    3    3    7                                       
CONECT    3    2    2    4   29                                       
CONECT    4    3    5    5   30                                       
CONECT    5    4    4    6   31                                       
CONECT    6    5    7    7   32                                       
CONECT    7    2    6    6    8                                       
CONECT    8    7    9   33   34                                       
CONECT    9    8   10   35                                            
CONECT   10    9   11   21   21                                       
CONECT   11   10   12   14   14                                       
CONECT   12   11   13   13                                            
CONECT   13   12   12   15   36                                       
CONECT   14   11   11   15   19                                       
CONECT   15   13   14   16                                            
CONECT   16   15   17   18   37                                       
CONECT   17   16   38   39   40                                       
CONECT   18   16   41   42   43                                       
CONECT   19   14   20   20                                            
CONECT   20   19   19   21   22                                       
CONECT   21   10   10   20                                            
CONECT   22   20   23   44                                            
CONECT   23   22   24   26   45                                       
CONECT   24   23   25   46   47                                       
CONECT   25   24   48   49   50                                       
CONECT   26   23   27   51   52                                       
CONECT   27   26   53                                                 
CONECT   28    1                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    8                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   13                                                      
CONECT   37   16                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   27                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
