COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.622   1.555   1.604  1.00  0.00           C  
HETATM    2  C   UNL     1       3.646   0.373  -0.216  1.00  0.00           C  
HETATM    3  C   UNL     1       1.471   1.332   0.394  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.725   0.725  -0.393  1.00  0.00           C  
HETATM    5  C   UNL     1       0.617   0.379  -0.165  1.00  0.00           C  
HETATM    6  C   UNL     1       1.018  -0.992  -0.503  1.00  0.00           C  
HETATM    7  C   UNL     1       3.158  -0.403  -1.410  1.00  0.00           C  
HETATM    8  C   UNL     1       4.154  -0.762  -2.505  1.00  0.00           C  
HETATM    9  C   UNL     1       3.082   0.301  -2.759  1.00  0.00           C  
HETATM   10  C   UNL     1       0.049  -2.058  -0.158  1.00  0.00           C  
HETATM   11  C   UNL     1       0.051  -3.261  -0.866  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.853  -4.251  -0.540  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.761  -4.052   0.486  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.624   2.328  -0.287  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.601   1.488  -0.856  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.524   4.480  -0.236  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.223   3.517   0.006  1.00  0.00           C  
HETATM   18 CL   UNL     1      -2.900  -5.300   0.887  1.00  0.00          Cl  
HETATM   19  C   UNL     1      -1.767  -2.861   1.192  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.864  -1.866   0.878  1.00  0.00           C  
HETATM   21  N   UNL     1       2.115  -1.380  -1.064  1.00  0.00           N  
HETATM   22  N   UNL     1       4.854   0.475   0.248  1.00  0.00           N  
HETATM   23  N   UNL     1       4.842   1.166   1.336  1.00  0.00           N  
HETATM   24  N   UNL     1       2.831   1.096   0.601  1.00  0.00           N  
HETATM   25  C   UNL     1       3.179   2.354   2.802  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.201   1.978  -0.043  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.342   2.912   0.538  1.00  0.00           C  
HETATM   28  C   UNL     1       0.979   2.587   0.747  1.00  0.00           C  
HETATM   29  N   UNL     1      -4.515   3.427  -0.370  1.00  0.00           N  
HETATM   30  N   UNL     1      -4.728   2.148  -0.900  1.00  0.00           N  
HETATM   31  H   UNL     1      -1.393   0.007  -0.845  1.00  0.00           H  
HETATM   32  H   UNL     1       5.182  -0.422  -2.382  1.00  0.00           H  
HETATM   33  H   UNL     1       4.034  -1.727  -2.999  1.00  0.00           H  
HETATM   34  H   UNL     1       2.257   0.036  -3.420  1.00  0.00           H  
HETATM   35  H   UNL     1       3.405   1.341  -2.803  1.00  0.00           H  
HETATM   36  H   UNL     1       0.758  -3.416  -1.667  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.853  -5.182  -1.087  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.446   0.475  -1.197  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.528   5.095  -1.136  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.507   4.027  -0.101  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.289   5.102   0.628  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.749   4.377   0.457  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.478  -2.711   1.992  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.870  -0.937   1.429  1.00  0.00           H  
HETATM   45  H   UNL     1       3.234   3.418   2.570  1.00  0.00           H  
HETATM   46  H   UNL     1       2.152   2.091   3.055  1.00  0.00           H  
HETATM   47  H   UNL     1       3.829   2.132   3.648  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.712   3.886   0.822  1.00  0.00           H  
HETATM   49  H   UNL     1       1.642   3.314   1.192  1.00  0.00           H  
CONECT    1   24   25   23   23                                       
CONECT    2    7   24   22   22                                       
CONECT    3    5    5   28   24                                       
CONECT    4   26   26    5   31                                       
CONECT    5    4    6    3    3                                       
CONECT    6   10   21   21    5                                       
CONECT    7   21    8    9    2                                       
CONECT    8    7    9   32   33                                       
CONECT    9    7    8   34   35                                       
CONECT   10   20   20   11    6                                       
CONECT   11   12   12   10   36                                       
CONECT   12   13   11   11   37                                       
CONECT   13   18   19   19   12                                       
CONECT   14   15   17   17   26                                       
CONECT   15   30   30   14   38                                       
CONECT   16   29   39   40   41                                       
CONECT   17   29   14   14   42                                       
CONECT   18   13                                                      
CONECT   19   13   13   20   43                                       
CONECT   20   19   10   10   44                                       
CONECT   21    6    6    7                                            
CONECT   22    2    2   23                                            
CONECT   23    1    1   22                                            
CONECT   24    3    2    1                                            
CONECT   25    1   45   46   47                                       
CONECT   26   14    4    4   27                                       
CONECT   27   26   28   28   48                                       
CONECT   28   27   27    3   49                                       
CONECT   29   30   16   17                                            
CONECT   30   15   15   29                                            
CONECT   31    4                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   25                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
