COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.072   0.003  -2.423  1.00  0.00           C  
HETATM    2  C   UNL     1       2.012  -3.186   0.785  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.667   2.270  -1.296  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.786   0.925   0.972  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.023   0.323   1.110  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.572  -1.041  -0.805  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.764  -1.318   0.372  1.00  0.00           C  
HETATM    8  C   UNL     1       0.147   1.562   0.376  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.248   0.399  -0.274  1.00  0.00           C  
HETATM   10  C   UNL     1       0.694  -0.558  -0.624  1.00  0.00           C  
HETATM   11  C   UNL     1       2.033  -0.352  -0.326  1.00  0.00           C  
HETATM   12  C   UNL     1       2.424   0.819   0.324  1.00  0.00           C  
HETATM   13  C   UNL     1       1.481   1.772   0.669  1.00  0.00           C  
HETATM   14  C   UNL     1       4.255  -0.707  -1.080  1.00  0.00           C  
HETATM   15  C   UNL     1       4.706   0.291  -0.045  1.00  0.00           C  
HETATM   16  C   UNL     1       4.192   2.016   1.615  1.00  0.00           C  
HETATM   17  C   UNL     1       3.185  -2.274   0.420  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.594   1.201  -0.205  1.00  0.00           C  
HETATM   19  C   UNL     1       2.408  -2.040   1.718  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.943   0.544  -0.055  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.416  -0.660   0.221  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.335  -0.439  -0.943  1.00  0.00           C  
HETATM   23  N   UNL     1       2.984  -1.314  -0.673  1.00  0.00           N  
HETATM   24  N   UNL     1       3.783   1.025   0.616  1.00  0.00           N  
HETATM   25  N   UNL     1      -1.599   0.192  -0.574  1.00  0.00           N  
HETATM   26  O   UNL     1       5.886   0.434   0.194  1.00  0.00           O  
HETATM   27  H   UNL     1       3.313   0.779  -2.323  1.00  0.00           H  
HETATM   28  H   UNL     1       5.016   0.455  -2.727  1.00  0.00           H  
HETATM   29  H   UNL     1       3.756  -0.720  -3.176  1.00  0.00           H  
HETATM   30  H   UNL     1       1.090  -3.073   0.213  1.00  0.00           H  
HETATM   31  H   UNL     1       2.244  -4.201   1.107  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.692   2.745  -1.405  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.952   1.807  -2.241  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.408   3.021  -1.021  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.481   1.696   1.664  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.682   0.620   1.912  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.878  -1.810  -1.499  1.00  0.00           H  
HETATM   38  H   UNL     1      -8.506  -0.760  -0.200  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.712  -2.341   0.000  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.047  -1.327   1.424  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.589   2.304   0.648  1.00  0.00           H  
HETATM   42  H   UNL     1       0.385  -1.462  -1.128  1.00  0.00           H  
HETATM   43  H   UNL     1       1.787   2.677   1.173  1.00  0.00           H  
HETATM   44  H   UNL     1       5.011  -1.485  -1.183  1.00  0.00           H  
HETATM   45  H   UNL     1       4.245   1.542   2.595  1.00  0.00           H  
HETATM   46  H   UNL     1       5.171   2.416   1.351  1.00  0.00           H  
HETATM   47  H   UNL     1       3.463   2.826   1.642  1.00  0.00           H  
HETATM   48  H   UNL     1       4.189  -2.689   0.503  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.309   1.664   0.740  1.00  0.00           H  
HETATM   50  H   UNL     1       1.748  -1.174   1.760  1.00  0.00           H  
HETATM   51  H   UNL     1       2.902  -2.301   2.654  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.676  -0.737  -1.745  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.875  -0.620  -1.028  1.00  0.00           H  
CONECT    1   14   27   28   29                                       
CONECT    2   17   19   30   31                                       
CONECT    3   18   32   33   34                                       
CONECT    4   20   20    5   35                                       
CONECT    5    4   21   21   36                                       
CONECT    6   22   22   21   37                                       
CONECT    7   21   38   39   40                                       
CONECT    8   13   13    9   41                                       
CONECT    9    8   25   10   10                                       
CONECT   10    9    9   11   42                                       
CONECT   11   12   12   10   23                                       
CONECT   12   13   24   11   11                                       
CONECT   13    8    8   12   43                                       
CONECT   14   15    1   23   44                                       
CONECT   15   24   26   26   14                                       
CONECT   16   24   45   46   47                                       
CONECT   17   23    2   19   48                                       
CONECT   18   25    3   20   49                                       
CONECT   19   17    2   50   51                                       
CONECT   20   18    4    4   22                                       
CONECT   21    5    5    6    7                                       
CONECT   22   20    6    6   52                                       
CONECT   23   14   11   17                                            
CONECT   24   16   12   15                                            
CONECT   25    9   18   53                                            
CONECT   26   15   15                                                 
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42   10                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   22                                                      
CONECT   53   25                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
