COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.666   1.524  -0.719  1.00  0.00           C  
HETATM    2  C   UNL     1       6.767   1.570   0.345  1.00  0.00           C  
HETATM    3  N   UNL     1       7.513   0.304   0.330  1.00  0.00           N  
HETATM    4  C   UNL     1       8.684   0.372   1.214  1.00  0.00           C  
HETATM    5  C   UNL     1       6.648  -0.828   0.688  1.00  0.00           C  
HETATM    6  C   UNL     1       5.541  -0.973  -0.362  1.00  0.00           C  
HETATM    7  N   UNL     1       4.851   0.319  -0.495  1.00  0.00           N  
HETATM    8  C   UNL     1       3.456   0.401  -0.411  1.00  0.00           C  
HETATM    9  C   UNL     1       2.713  -0.733  -0.337  1.00  0.00           C  
HETATM   10  C   UNL     1       2.825   1.659  -0.397  1.00  0.00           C  
HETATM   11  C   UNL     1       1.468   1.727  -0.315  1.00  0.00           C  
HETATM   12  C   UNL     1       0.715   0.539  -0.245  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.612   0.611  -0.165  1.00  0.00           N  
HETATM   14  N   UNL     1       1.353  -0.670  -0.255  1.00  0.00           N  
HETATM   15  C   UNL     1       0.639  -1.814  -0.188  1.00  0.00           C  
HETATM   16  O   UNL     1       1.203  -2.897  -0.196  1.00  0.00           O  
HETATM   17  C   UNL     1      -0.752  -1.743  -0.108  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.361  -0.488  -0.097  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.836  -0.378  -0.008  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.427   0.849   0.004  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.629  -1.548   0.058  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.982  -1.438   0.134  1.00  0.00           C  
HETATM   23  F   UNL     1      -5.753  -2.545   0.193  1.00  0.00           F  
HETATM   24  C   UNL     1      -5.574  -0.155   0.145  1.00  0.00           C  
HETATM   25  N   UNL     1      -6.837   0.240   0.210  1.00  0.00           N  
HETATM   26  N   UNL     1      -4.783   0.962   0.085  1.00  0.00           N  
HETATM   27  C   UNL     1      -5.618   2.047   0.112  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.881   1.574   0.189  1.00  0.00           C  
HETATM   29  C   UNL     1      -8.132   2.414   0.245  1.00  0.00           C  
HETATM   30  H   UNL     1       5.038   2.411  -0.635  1.00  0.00           H  
HETATM   31  H   UNL     1       6.116   1.482  -1.710  1.00  0.00           H  
HETATM   32  H   UNL     1       7.447   2.395   0.130  1.00  0.00           H  
HETATM   33  H   UNL     1       6.318   1.716   1.328  1.00  0.00           H  
HETATM   34  H   UNL     1       8.358   0.573   2.234  1.00  0.00           H  
HETATM   35  H   UNL     1       9.217  -0.578   1.184  1.00  0.00           H  
HETATM   36  H   UNL     1       9.345   1.171   0.880  1.00  0.00           H  
HETATM   37  H   UNL     1       7.240  -1.742   0.720  1.00  0.00           H  
HETATM   38  H   UNL     1       6.201  -0.649   1.666  1.00  0.00           H  
HETATM   39  H   UNL     1       5.979  -1.254  -1.320  1.00  0.00           H  
HETATM   40  H   UNL     1       4.833  -1.738  -0.045  1.00  0.00           H  
HETATM   41  H   UNL     1       3.204  -1.695  -0.343  1.00  0.00           H  
HETATM   42  H   UNL     1       3.412   2.563  -0.451  1.00  0.00           H  
HETATM   43  H   UNL     1       0.971   2.686  -0.308  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.346  -2.643  -0.054  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.817   1.738  -0.051  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.163  -2.523   0.049  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.323   3.085   0.080  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.374   2.635   1.285  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.969   3.346  -0.296  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.957   1.867  -0.212  1.00  0.00           H  
CONECT    1    7    2   30   31                                       
CONECT    2    1    3   32   33                                       
CONECT    3    2    5    4                                            
CONECT    4    3   34   35   36                                       
CONECT    5    6    3   37   38                                       
CONECT    6    7    5   39   40                                       
CONECT    7    8    1    6                                            
CONECT    8   10    9    9    7                                       
CONECT    9   14    8    8   41                                       
CONECT   10   11   11    8   42                                       
CONECT   11   12   10   10   43                                       
CONECT   12   13   13   11   14                                       
CONECT   13   18   12   12                                            
CONECT   14   12   15    9                                            
CONECT   15   17   14   16   16                                       
CONECT   16   15   15                                                 
CONECT   17   18   18   15   44                                       
CONECT   18   19   13   17   17                                       
CONECT   19   21   20   20   18                                       
CONECT   20   26   19   19   45                                       
CONECT   21   22   22   19   46                                       
CONECT   22   23   24   21   21                                       
CONECT   23   22                                                      
CONECT   24   25   25   22   26                                       
CONECT   25   24   24   28                                            
CONECT   26   24   27   20                                            
CONECT   27   28   28   26   47                                       
CONECT   28   25   29   27   27                                       
CONECT   29   28   48   49   50                                       
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   17                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   27                                                      
CONECT   48   29                                                      
CONECT   49   29                                                      
CONECT   50   29                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
