COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.961   0.813   0.790  1.00  0.00           N  
HETATM    2  N   UNL     1      -2.525   2.648  -1.488  1.00  0.00           N  
HETATM    3  C   UNL     1       1.035  -0.393   1.638  1.00  0.00           C  
HETATM    4  C   UNL     1       0.001   0.512   1.018  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.098   0.824  -0.052  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.669   1.864  -0.850  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.826   2.496  -1.408  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.756   1.271  -0.509  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.010  -0.427   0.867  1.00  0.00           C  
HETATM   10  C   UNL     1       1.411  -1.465   0.649  1.00  0.00           C  
HETATM   11  C   UNL     1       0.831  -3.559  -0.382  1.00  0.00           C  
HETATM   12  C   UNL     1       2.556  -1.409  -0.112  1.00  0.00           C  
HETATM   13  C   UNL     1       3.543  -0.273  -0.006  1.00  0.00           C  
HETATM   14 CL   UNL     1      -0.251  -4.907  -0.541  1.00  0.00          Cl  
HETATM   15  C   UNL     1       0.551  -2.547   0.513  1.00  0.00           C  
HETATM   16  C   UNL     1       1.978  -3.496  -1.153  1.00  0.00           C  
HETATM   17  C   UNL     1       2.836  -2.424  -1.017  1.00  0.00           C  
HETATM   18  C   UNL     1       3.066   2.100   0.402  1.00  0.00           C  
HETATM   19  O   UNL     1       2.366   2.949   0.919  1.00  0.00           O  
HETATM   20  N   UNL     1       3.945   2.445  -0.559  1.00  0.00           N  
HETATM   21  C   UNL     1       4.921   1.466  -1.045  1.00  0.00           C  
HETATM   22  C   UNL     1       3.925   3.799  -1.118  1.00  0.00           C  
HETATM   23  C   UNL     1       2.254   0.441   2.027  1.00  0.00           C  
HETATM   24  O   UNL     1       0.234   1.695   0.883  1.00  0.00           O  
HETATM   25  N   UNL     1      -1.181   0.007   0.613  1.00  0.00           N  
HETATM   26  C   UNL     1      -3.487   0.605   0.078  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.360  -0.589   0.953  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.229   0.257   0.267  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.370   1.468  -0.622  1.00  0.00           C  
HETATM   30  H   UNL     1       0.614  -0.859   2.529  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.609   2.042  -0.959  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.481   3.164  -1.948  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.442   1.919  -1.035  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.347  -1.090   1.404  1.00  0.00           H  
HETATM   35  H   UNL     1       3.781   0.096  -1.003  1.00  0.00           H  
HETATM   36  H   UNL     1       4.454  -0.628   0.476  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.345  -2.597   1.114  1.00  0.00           H  
HETATM   38  H   UNL     1       2.201  -4.283  -1.859  1.00  0.00           H  
HETATM   39  H   UNL     1       3.731  -2.374  -1.618  1.00  0.00           H  
HETATM   40  H   UNL     1       4.513   0.946  -1.912  1.00  0.00           H  
HETATM   41  H   UNL     1       5.840   1.978  -1.328  1.00  0.00           H  
HETATM   42  H   UNL     1       5.135   0.744  -0.256  1.00  0.00           H  
HETATM   43  H   UNL     1       3.138   4.379  -0.637  1.00  0.00           H  
HETATM   44  H   UNL     1       4.889   4.278  -0.944  1.00  0.00           H  
HETATM   45  H   UNL     1       3.735   3.746  -2.190  1.00  0.00           H  
HETATM   46  H   UNL     1       2.913  -0.146   2.666  1.00  0.00           H  
HETATM   47  H   UNL     1       1.933   1.340   2.553  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.395  -0.924   0.783  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.763  -1.385   1.561  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.295   0.107   0.353  1.00  0.00           H  
CONECT    1   23   18   13                                            
CONECT    2    7    6    6                                            
CONECT    3    4   23   10   30                                       
CONECT    4   25    3   24   24                                       
CONECT    5   26   26    6   25                                       
CONECT    6    2    2    5   31                                       
CONECT    7   29   29    2   32                                       
CONECT    8   28   28   29   33                                       
CONECT    9   27   27   26   34                                       
CONECT   10    3   15   15   12                                       
CONECT   11   15   14   16   16                                       
CONECT   12   10   13   17   17                                       
CONECT   13    1   12   35   36                                       
CONECT   14   11                                                      
CONECT   15   10   10   11   37                                       
CONECT   16   11   11   17   38                                       
CONECT   17   12   12   16   39                                       
CONECT   18   19   19    1   20                                       
CONECT   19   18   18                                                 
CONECT   20   18   22   21                                            
CONECT   21   20   40   41   42                                       
CONECT   22   20   43   44   45                                       
CONECT   23    3    1   46   47                                       
CONECT   24    4    4                                                 
CONECT   25    5    4   48                                            
CONECT   26   29    9    5    5                                       
CONECT   27   28    9    9   49                                       
CONECT   28    8    8   27   50                                       
CONECT   29    8    7    7   26                                       
CONECT   30    3                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   21                                                      
CONECT   41   21                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   22                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   23                                                      
CONECT   48   25                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
