COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.226  -2.366  -0.359  1.00  0.00           C  
HETATM    2  C   UNL     1       3.791  -2.781  -0.155  1.00  0.00           C  
HETATM    3  C   UNL     1       1.549  -2.223  -0.164  1.00  0.00           C  
HETATM    4  C   UNL     1       1.190  -3.520   0.211  1.00  0.00           C  
HETATM    5  C   UNL     1       2.183  -4.461   0.410  1.00  0.00           C  
HETATM    6  C   UNL     1       3.505  -4.081   0.222  1.00  0.00           C  
HETATM    7  C   UNL     1       0.503  -1.206  -0.380  1.00  0.00           C  
HETATM    8  C   UNL     1       0.640   0.165  -0.263  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.413  -0.228  -0.827  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.650   0.415  -1.311  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.014   0.620  -1.397  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.810   0.405   1.088  1.00  0.00           C  
HETATM   13  C   UNL     1       1.876   0.895   0.105  1.00  0.00           C  
HETATM   14  C   UNL     1       2.415   1.804  -0.758  1.00  0.00           C  
HETATM   15  C   UNL     1       4.167   2.259   0.768  1.00  0.00           C  
HETATM   16  C   UNL     1       5.317   3.753  -0.307  1.00  0.00           C  
HETATM   17  C   UNL     1       2.494   0.656   1.353  1.00  0.00           C  
HETATM   18  N   UNL     1       2.828  -1.901  -0.334  1.00  0.00           N  
HETATM   19  N   UNL     1      -0.555   0.714  -0.545  1.00  0.00           N  
HETATM   20  N   UNL     1      -0.807  -1.431  -0.744  1.00  0.00           N  
HETATM   21  C   UNL     1      -2.857  -0.006  -1.197  1.00  0.00           C  
HETATM   22  N   UNL     1      -3.663   0.098   0.022  1.00  0.00           N  
HETATM   23  C   UNL     1      -5.043   0.306  -0.068  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.774   0.724  -0.247  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.172   0.621   0.994  1.00  0.00           C  
HETATM   26  F   UNL     1      -5.223   0.300   2.300  1.00  0.00           F  
HETATM   27  N   UNL     1       3.548   2.477  -0.430  1.00  0.00           N  
HETATM   28  N   UNL     1       5.237   3.046   0.812  1.00  0.00           N  
HETATM   29  N   UNL     1       4.314   3.444  -1.096  1.00  0.00           N  
HETATM   30  C   UNL     1       3.627   1.332   1.680  1.00  0.00           C  
HETATM   31  H   UNL     1       5.634  -1.996   0.581  1.00  0.00           H  
HETATM   32  H   UNL     1       5.808  -3.223  -0.697  1.00  0.00           H  
HETATM   33  H   UNL     1       5.272  -1.577  -1.110  1.00  0.00           H  
HETATM   34  H   UNL     1       0.151  -3.783   0.345  1.00  0.00           H  
HETATM   35  H   UNL     1       1.936  -5.471   0.701  1.00  0.00           H  
HETATM   36  H   UNL     1       4.304  -4.793   0.369  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.058   0.334  -2.211  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.488   0.701  -2.365  1.00  0.00           H  
HETATM   39  H   UNL     1       1.938   1.988  -1.710  1.00  0.00           H  
HETATM   40  H   UNL     1       6.089   4.472  -0.535  1.00  0.00           H  
HETATM   41  H   UNL     1       2.069  -0.058   2.042  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.218  -2.294  -0.908  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.947   0.915  -1.772  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.211  -0.845  -1.796  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.240   0.023   0.891  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.839   0.885  -0.318  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.768   0.703   1.891  1.00  0.00           H  
HETATM   48  H   UNL     1       4.112   1.155   2.628  1.00  0.00           H  
CONECT    1    2   31   32   33                                       
CONECT    2    1   18   18    6                                       
CONECT    3   18    4    4    7                                       
CONECT    4    3    3    5   34                                       
CONECT    5    4    6    6   35                                       
CONECT    6    2    5    5   36                                       
CONECT    7    3    8    8   20                                       
CONECT    8    7    7   19   13                                       
CONECT    9   19   19   20   21                                       
CONECT   10   23   23   11   37                                       
CONECT   11   10   24   24   38                                       
CONECT   12   23   25   25   26                                       
CONECT   13    8   14   14   17                                       
CONECT   14   13   13   27   39                                       
CONECT   15   27   28   28   30                                       
CONECT   16   28   29   29   40                                       
CONECT   17   13   30   30   41                                       
CONECT   18    2    2    3                                            
CONECT   19    8    9    9                                            
CONECT   20    7    9   42                                            
CONECT   21    9   22   43   44                                       
CONECT   22   21   23   45                                            
CONECT   23   22   10   10   12                                       
CONECT   24   11   11   25   46                                       
CONECT   25   24   12   12   47                                       
CONECT   26   12                                                      
CONECT   27   14   15   29                                            
CONECT   28   15   15   16                                            
CONECT   29   27   16   16                                            
CONECT   30   15   17   17   48                                       
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   14                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   30                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
