COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.195   2.777  -0.539  1.00  0.00           C  
HETATM    2  N   UNL     1       5.905  -1.438   0.168  1.00  0.00           N  
HETATM    3  C   UNL     1       6.389  -2.791   0.452  1.00  0.00           C  
HETATM    4  C   UNL     1       7.852  -2.943   0.876  1.00  0.00           C  
HETATM    5  C   UNL     1       7.407  -3.395  -0.518  1.00  0.00           C  
HETATM    6  N   UNL     1       0.935   2.095  -0.032  1.00  0.00           N  
HETATM    7  C   UNL     1       0.014   1.118  -0.155  1.00  0.00           C  
HETATM    8  O   UNL     1       0.358  -0.005  -0.469  1.00  0.00           O  
HETATM    9  C   UNL     1      -1.411   1.413   0.090  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.361   0.400  -0.038  1.00  0.00           C  
HETATM   11  C   UNL     1       2.295   1.792  -0.150  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.116   2.990   0.686  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.803   2.707   0.457  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.080   1.986   0.556  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.697   0.680   0.193  1.00  0.00           C  
HETATM   16  N   UNL     1      -4.850  -0.084   0.149  1.00  0.00           N  
HETATM   17  C   UNL     1      -5.933   0.695   0.469  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.535   1.951   0.724  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.901  -1.395  -0.162  1.00  0.00           C  
HETATM   20  O   UNL     1      -3.880  -1.995  -0.433  1.00  0.00           O  
HETATM   21  O   UNL     1      -6.083  -2.038  -0.174  1.00  0.00           O  
HETATM   22  C   UNL     1       2.746   0.509   0.119  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.062  -3.449  -0.518  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.487  -4.004  -0.478  1.00  0.00           C  
HETATM   25  C   UNL     1       4.104   0.212  -0.001  1.00  0.00           C  
HETATM   26  C   UNL     1       4.999   1.209  -0.392  1.00  0.00           C  
HETATM   27  C   UNL     1       4.541   2.483  -0.658  1.00  0.00           C  
HETATM   28  C   UNL     1       2.701   4.170  -0.837  1.00  0.00           C  
HETATM   29  C   UNL     1       4.593  -1.153   0.285  1.00  0.00           C  
HETATM   30  O   UNL     1       3.811  -2.020   0.626  1.00  0.00           O  
HETATM   31  H   UNL     1       6.529  -0.746  -0.103  1.00  0.00           H  
HETATM   32  H   UNL     1       5.662  -3.466   0.903  1.00  0.00           H  
HETATM   33  H   UNL     1       8.453  -2.037   0.943  1.00  0.00           H  
HETATM   34  H   UNL     1       8.086  -3.719   1.605  1.00  0.00           H  
HETATM   35  H   UNL     1       7.349  -4.467  -0.705  1.00  0.00           H  
HETATM   36  H   UNL     1       7.716  -2.785  -1.367  1.00  0.00           H  
HETATM   37  H   UNL     1       0.654   3.007   0.140  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.056  -0.598  -0.317  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.413   3.991   0.965  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.060   3.484   0.559  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.956   0.349   0.510  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.168   2.779   1.008  1.00  0.00           H  
HETATM   43  H   UNL     1       2.049  -0.258   0.422  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.652  -3.572  -1.520  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.442  -3.988   0.198  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.108  -3.465  -1.194  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.472  -5.063  -0.737  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.898  -3.881   0.524  1.00  0.00           H  
HETATM   49  H   UNL     1       6.051   0.984  -0.486  1.00  0.00           H  
HETATM   50  H   UNL     1       5.235   3.253  -0.961  1.00  0.00           H  
HETATM   51  H   UNL     1       2.722   4.766   0.075  1.00  0.00           H  
HETATM   52  H   UNL     1       3.345   4.630  -1.587  1.00  0.00           H  
HETATM   53  H   UNL     1       1.680   4.120  -1.216  1.00  0.00           H  
CONECT    1   27   28   11   11                                       
CONECT    2    3   29   31                                            
CONECT    3    4    2    5   32                                       
CONECT    4    5    3   33   34                                       
CONECT    5    4    3   35   36                                       
CONECT    6   11    7   37                                            
CONECT    7    6    8    8    9                                       
CONECT    8    7    7                                                 
CONECT    9    7   13   13   10                                       
CONECT   10    9   15   15   38                                       
CONECT   11    1    1   22    6                                       
CONECT   12   13   14   14   39                                       
CONECT   13    9    9   12   40                                       
CONECT   14   12   12   15   18                                       
CONECT   15   10   10   14   16                                       
CONECT   16   15   17   19                                            
CONECT   17   18   18   16   41                                       
CONECT   18   14   17   17   42                                       
CONECT   19   21   16   20   20                                       
CONECT   20   19   19                                                 
CONECT   21   23   19                                                 
CONECT   22   25   25   11   43                                       
CONECT   23   24   21   44   45                                       
CONECT   24   23   46   47   48                                       
CONECT   25   26   29   22   22                                       
CONECT   26   27   27   25   49                                       
CONECT   27   26   26    1   50                                       
CONECT   28    1   51   52   53                                       
CONECT   29    2   25   30   30                                       
CONECT   30   29   29                                                 
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38   10                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
CONECT   52   28                                                      
CONECT   53   28                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
