COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.200  -1.261   0.054  1.00  0.00           C  
HETATM    2  C   UNL     1       2.093  -2.316   0.048  1.00  0.00           C  
HETATM    3  C   UNL     1       3.452  -2.039   0.059  1.00  0.00           C  
HETATM    4  N   UNL     1       3.853  -0.779   0.072  1.00  0.00           N  
HETATM    5  N   UNL     1       1.668  -0.022   0.071  1.00  0.00           N  
HETATM    6  C   UNL     1       2.972   0.211   0.074  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.282  -1.501   0.049  1.00  0.00           C  
HETATM    8  C   UNL     1       4.459  -3.160   0.057  1.00  0.00           C  
HETATM    9  C   UNL     1       4.864   1.795   0.095  1.00  0.00           C  
HETATM   10  C   UNL     1       5.092   3.308   0.106  1.00  0.00           C  
HETATM   11  C   UNL     1       5.800   3.925  -1.102  1.00  0.00           C  
HETATM   12  C   UNL     1       6.533   3.804   0.235  1.00  0.00           C  
HETATM   13  C   UNL     1       1.624  -3.744   0.025  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.594  -2.937  -0.360  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.975  -0.516  -0.910  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.787   1.103  -0.734  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.186   1.301  -0.210  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.235   0.570  -0.741  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.519   0.753  -0.258  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.753   1.665   0.753  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.705   2.395   1.282  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.421   2.208   0.805  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.881  -0.058   1.206  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.874  -1.206   1.439  1.00  0.00           C  
HETATM   25  F   UNL     1      -5.005  -0.322  -1.730  1.00  0.00           F  
HETATM   26  N   UNL     1       3.425   1.518   0.085  1.00  0.00           N  
HETATM   27  N   UNL     1      -2.250  -0.168  -0.230  1.00  0.00           N  
HETATM   28  O   UNL     1       0.247  -3.820   0.398  1.00  0.00           O  
HETATM   29  H   UNL     1       4.709  -3.423  -0.971  1.00  0.00           H  
HETATM   30  H   UNL     1       5.361  -2.839   0.580  1.00  0.00           H  
HETATM   31  H   UNL     1       4.037  -4.029   0.562  1.00  0.00           H  
HETATM   32  H   UNL     1       5.322   1.365  -0.796  1.00  0.00           H  
HETATM   33  H   UNL     1       5.313   1.353   0.984  1.00  0.00           H  
HETATM   34  H   UNL     1       4.312   3.898   0.588  1.00  0.00           H  
HETATM   35  H   UNL     1       6.103   3.253  -1.905  1.00  0.00           H  
HETATM   36  H   UNL     1       5.485   4.920  -1.415  1.00  0.00           H  
HETATM   37  H   UNL     1       6.702   4.720   0.802  1.00  0.00           H  
HETATM   38  H   UNL     1       7.319   3.053   0.312  1.00  0.00           H  
HETATM   39  H   UNL     1       1.747  -4.150  -0.979  1.00  0.00           H  
HETATM   40  H   UNL     1       2.220  -4.330   0.724  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.640  -3.159  -0.147  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.404  -3.062  -1.426  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.362   0.375  -1.048  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.173  -0.995  -1.869  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.807   1.081  -1.824  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.153   1.924  -0.399  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.338   0.183  -0.672  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.755   1.808   1.130  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.889   3.108   2.072  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.602   2.776   1.223  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.761  -0.191   1.835  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.413   0.906   1.407  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.385  -2.086   1.827  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.089  -0.888   2.125  1.00  0.00           H  
HETATM   55  H   UNL     1       2.790   2.252   0.087  1.00  0.00           H  
CONECT    1    2    7    5    5                                       
CONECT    2   13    3    3    1                                       
CONECT    3    8    2    2    4                                       
CONECT    4    3    6    6                                            
CONECT    5    1    1    6                                            
CONECT    6    4    4    5   26                                       
CONECT    7   14    1   15   24                                       
CONECT    8    3   29   30   31                                       
CONECT    9   26   10   32   33                                       
CONECT   10    9   11   12   34                                       
CONECT   11   10   12   35   36                                       
CONECT   12   11   10   37   38                                       
CONECT   13   28    2   39   40                                       
CONECT   14   28    7   41   42                                       
CONECT   15    7   27   43   44                                       
CONECT   16   27   17   45   46                                       
CONECT   17   16   22   22   18                                       
CONECT   18   17   25   19   19                                       
CONECT   19   18   18   20   47                                       
CONECT   20   21   21   19   48                                       
CONECT   21   22   20   20   49                                       
CONECT   22   17   17   21   50                                       
CONECT   23   24   27   51   52                                       
CONECT   24    7   23   53   54                                       
CONECT   25   18                                                      
CONECT   26    6    9   55                                            
CONECT   27   15   16   23                                            
CONECT   28   13   14                                                 
CONECT   29    8                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   23                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   24                                                      
CONECT   55   26                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
