COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.759   1.182   0.346  1.00  0.00           C  
HETATM    2  C   UNL     1       4.224   0.176  -0.481  1.00  0.00           C  
HETATM    3  C   UNL     1       5.587  -0.103  -0.528  1.00  0.00           C  
HETATM    4  C   UNL     1       6.476   0.645   0.269  1.00  0.00           C  
HETATM    5  C   UNL     1       5.984   1.659   1.098  1.00  0.00           C  
HETATM    6  C   UNL     1       4.646   1.919   1.133  1.00  0.00           C  
HETATM    7  N   UNL     1       7.690  -0.841  -0.874  1.00  0.00           N  
HETATM    8  C   UNL     1      -0.733  -0.206   0.046  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.109   0.082  -0.023  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.022   1.871  -1.279  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.258   2.914   0.769  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.073  -4.961   0.837  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.040  -3.843   0.992  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.594  -3.365  -0.391  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.577  -2.264  -0.238  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.253  -2.579  -0.168  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.304  -1.556  -0.025  1.00  0.00           C  
HETATM   18  C   UNL     1       1.076  -1.823   0.052  1.00  0.00           C  
HETATM   19  N   UNL     1       1.905  -0.810   0.185  1.00  0.00           N  
HETATM   20  C   UNL     1       1.466   0.446   0.249  1.00  0.00           C  
HETATM   21  N   UNL     1       2.391   1.467   0.390  1.00  0.00           N  
HETATM   22  C   UNL     1       7.810   0.119  -0.003  1.00  0.00           C  
HETATM   23  N   UNL     1       6.346  -1.009  -1.222  1.00  0.00           N  
HETATM   24  N   UNL     1       0.186   0.756   0.182  1.00  0.00           N  
HETATM   25  C   UNL     1      -3.005  -0.941  -0.163  1.00  0.00           C  
HETATM   26  O   UNL     1      -2.544   1.367   0.048  1.00  0.00           O  
HETATM   27  C   UNL     1      -3.957   1.573   0.094  1.00  0.00           C  
HETATM   28  C   UNL     1      -4.518   1.590  -1.331  1.00  0.00           C  
HETATM   29  N   UNL     1      -6.257   3.165  -0.625  1.00  0.00           N  
HETATM   30  C   UNL     1      -5.769   3.157   0.760  1.00  0.00           C  
HETATM   31  H   UNL     1       3.533  -0.391  -1.087  1.00  0.00           H  
HETATM   32  H   UNL     1       6.662   2.234   1.711  1.00  0.00           H  
HETATM   33  H   UNL     1       4.269   2.702   1.774  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.421   1.898  -2.292  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.519   1.083  -0.713  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.899   2.892   1.798  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.758   3.716   0.226  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.629  -5.793   0.290  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.391  -5.302   1.822  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.936  -4.585   0.287  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.485  -3.012   1.539  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.178  -4.220   1.542  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.150  -4.197  -0.937  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.457  -2.989  -0.941  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.937  -3.610  -0.221  1.00  0.00           H  
HETATM   46  H   UNL     1       1.445  -2.837   0.003  1.00  0.00           H  
HETATM   47  H   UNL     1       2.090   2.380   0.519  1.00  0.00           H  
HETATM   48  H   UNL     1       8.733   0.464   0.440  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.060  -0.719  -0.221  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.424   0.767   0.660  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.345   0.623  -1.802  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.022   2.371  -1.908  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.233   3.417  -0.663  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.267   2.362   1.316  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.985   4.117   1.227  1.00  0.00           H  
HETATM   56  H   UNL     1       6.005  -1.662  -1.853  1.00  0.00           H  
CONECT    1   21    6    6    2                                       
CONECT    2    1    3    3   31                                       
CONECT    3    2    2    4   23                                       
CONECT    4    5    5    3   22                                       
CONECT    5    6    4    4   32                                       
CONECT    6    1    1    5   33                                       
CONECT    7   23   22   22                                            
CONECT    8   17    9   24   24                                       
CONECT    9   25   25    8   26                                       
CONECT   10   28   29   34   35                                       
CONECT   11   27   30   36   37                                       
CONECT   12   13   38   39   40                                       
CONECT   13   12   14   41   42                                       
CONECT   14   13   15   43   44                                       
CONECT   15   14   16   16   25                                       
CONECT   16   15   15   17   45                                       
CONECT   17   16   18   18    8                                       
CONECT   18   17   17   19   46                                       
CONECT   19   18   20   20                                            
CONECT   20   19   19   24   21                                       
CONECT   21   20    1   47                                            
CONECT   22    4    7    7   48                                       
CONECT   23    3    7   56                                            
CONECT   24    8    8   20                                            
CONECT   25   15    9    9   49                                       
CONECT   26    9   27                                                 
CONECT   27   26   11   28   50                                       
CONECT   28   27   10   51   52                                       
CONECT   29   30   10   53                                            
CONECT   30   11   29   54   55                                       
CONECT   31    2                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   16                                                      
CONECT   46   18                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   25                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
CONECT   55   30                                                      
CONECT   56   23                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
