COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.395   0.246   0.150  1.00  0.00           C  
HETATM    2  C   UNL     1       2.686  -0.461   1.305  1.00  0.00           C  
HETATM    3  C   UNL     1       3.444  -1.613   1.234  1.00  0.00           C  
HETATM    4  C   UNL     1       3.917  -2.067   0.011  1.00  0.00           C  
HETATM    5  C   UNL     1       3.637  -1.376  -1.148  1.00  0.00           C  
HETATM    6  C   UNL     1       2.871  -0.209  -1.091  1.00  0.00           C  
HETATM    7  N   UNL     1       2.437   0.669  -2.033  1.00  0.00           N  
HETATM    8  C   UNL     1       1.738   1.618  -1.461  1.00  0.00           C  
HETATM    9  N   UNL     1       1.677   1.402  -0.114  1.00  0.00           N  
HETATM   10  N   UNL     1       1.148   2.675  -2.121  1.00  0.00           N  
HETATM   11 CL   UNL     1       4.869  -3.517  -0.059  1.00  0.00          Cl  
HETATM   12  C   UNL     1       0.983   2.237   0.869  1.00  0.00           C  
HETATM   13  C   UNL     1       1.565   3.651   0.839  1.00  0.00           C  
HETATM   14  C   UNL     1       3.020   3.613   1.309  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.508   2.292   0.529  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.114   0.923   0.704  1.00  0.00           C  
HETATM   17  N   UNL     1      -2.442   0.750   0.552  1.00  0.00           N  
HETATM   18  O   UNL     1      -0.407  -0.022   0.982  1.00  0.00           O  
HETATM   19  C   UNL     1      -3.031  -0.581   0.722  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.543  -0.502   0.495  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.174  -1.863   0.794  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.686  -1.784   0.568  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.964  -1.401  -0.887  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.332  -0.040  -1.186  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.821  -0.119  -0.959  1.00  0.00           C  
HETATM   26  H   UNL     1       2.322  -0.112   2.260  1.00  0.00           H  
HETATM   27  H   UNL     1       3.670  -2.163   2.135  1.00  0.00           H  
HETATM   28  H   UNL     1       4.008  -1.735  -2.096  1.00  0.00           H  
HETATM   29  H   UNL     1       1.236   2.755  -3.084  1.00  0.00           H  
HETATM   30  H   UNL     1       0.646   3.338  -1.623  1.00  0.00           H  
HETATM   31  H   UNL     1       1.113   1.811   1.864  1.00  0.00           H  
HETATM   32  H   UNL     1       1.522   4.041  -0.178  1.00  0.00           H  
HETATM   33  H   UNL     1       0.986   4.297   1.500  1.00  0.00           H  
HETATM   34  H   UNL     1       3.073   3.142   2.291  1.00  0.00           H  
HETATM   35  H   UNL     1       3.617   3.041   0.599  1.00  0.00           H  
HETATM   36  H   UNL     1       3.408   4.630   1.374  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.007   2.998   1.194  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.634   2.615  -0.504  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.008   1.506   0.329  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.591  -1.268  -0.001  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.833  -0.939   1.732  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.970   0.251   1.158  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.747  -2.615   0.132  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.976  -2.136   1.831  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.136  -2.754   0.781  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.113  -1.031   1.230  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.536  -2.154  -1.549  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.041  -1.345  -1.048  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.531   0.233  -2.222  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.760   0.713  -0.523  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.371   0.851  -1.172  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.393  -0.872  -1.622  1.00  0.00           H  
CONECT    1    2    2    6    9                                       
CONECT    2    1    1    3   26                                       
CONECT    3    2    4    4   27                                       
CONECT    4    3    3    5   11                                       
CONECT    5    4    6    6   28                                       
CONECT    6    1    5    5    7                                       
CONECT    7    6    8    8                                            
CONECT    8    7    7    9   10                                       
CONECT    9    1    8   12                                            
CONECT   10    8   29   30                                            
CONECT   11    4                                                      
CONECT   12    9   13   15   31                                       
CONECT   13   12   14   32   33                                       
CONECT   14   13   34   35   36                                       
CONECT   15   12   16   37   38                                       
CONECT   16   15   17   18   18                                       
CONECT   17   16   19   39                                            
CONECT   18   16   16                                                 
CONECT   19   17   20   40   41                                       
CONECT   20   19   21   25   42                                       
CONECT   21   20   22   43   44                                       
CONECT   22   21   23   45   46                                       
CONECT   23   22   24   47   48                                       
CONECT   24   23   25   49   50                                       
CONECT   25   20   24   51   52                                       
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    5                                                      
CONECT   29   10                                                      
CONECT   30   10                                                      
CONECT   31   12                                                      
CONECT   32   13                                                      
CONECT   33   13                                                      
CONECT   34   14                                                      
CONECT   35   14                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   17                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   23                                                      
CONECT   49   24                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
CONECT   52   25                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
