COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -8.283   0.920   0.010  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.688   0.883  -1.238  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.633   0.022  -1.475  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.172  -0.802  -0.465  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.022  -1.741  -0.724  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.810  -1.507   0.436  1.00  0.00           C  
HETATM    7 CL   UNL     1      -9.608   2.001   0.308  1.00  0.00          Cl  
HETATM    8  N   UNL     1      -3.760  -1.064  -0.414  1.00  0.00           N  
HETATM    9  C   UNL     1      -1.807  -0.599   0.443  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.540  -0.683   1.255  1.00  0.00           C  
HETATM   11  N   UNL     1       0.491  -1.387   0.481  1.00  0.00           N  
HETATM   12  C   UNL     1       1.662  -1.699   1.322  1.00  0.00           C  
HETATM   13  C   UNL     1       2.551  -1.298   0.137  1.00  0.00           C  
HETATM   14  C   UNL     1       1.344  -0.434  -0.254  1.00  0.00           C  
HETATM   15  N   UNL     1       3.741  -0.531   0.512  1.00  0.00           N  
HETATM   16  C   UNL     1       4.830  -0.543  -0.283  1.00  0.00           C  
HETATM   17  O   UNL     1       4.823  -1.191  -1.312  1.00  0.00           O  
HETATM   18  C   UNL     1       6.028   0.229   0.095  1.00  0.00           C  
HETATM   19  C   UNL     1       7.188   0.305  -0.622  1.00  0.00           C  
HETATM   20  N   UNL     1       8.022   1.108   0.069  1.00  0.00           N  
HETATM   21  N   UNL     1       7.334   1.514   1.220  1.00  0.00           N  
HETATM   22  N   UNL     1       6.161   0.982   1.201  1.00  0.00           N  
HETATM   23  C   UNL     1       9.386   1.484  -0.312  1.00  0.00           C  
HETATM   24  C   UNL     1      10.516   0.527   0.073  1.00  0.00           C  
HETATM   25  C   UNL     1      10.077   0.644  -1.388  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.153   0.432  -0.438  1.00  0.00           C  
HETATM   27  N   UNL     1      -3.326   0.157  -0.947  1.00  0.00           N  
HETATM   28  C   UNL     1      -6.766  -0.765   0.783  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.825   0.092   1.019  1.00  0.00           C  
HETATM   30  H   UNL     1      -8.048   1.526  -2.028  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.168  -0.007  -2.450  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.125  -2.624  -0.094  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.026  -2.039  -1.773  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.846  -2.420   1.011  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.193   0.323   1.492  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.736  -1.227   2.178  1.00  0.00           H  
HETATM   37  H   UNL     1       1.765  -1.040   2.185  1.00  0.00           H  
HETATM   38  H   UNL     1       1.738  -2.754   1.586  1.00  0.00           H  
HETATM   39  H   UNL     1       2.764  -2.112  -0.556  1.00  0.00           H  
HETATM   40  H   UNL     1       1.151  -0.417  -1.326  1.00  0.00           H  
HETATM   41  H   UNL     1       1.362   0.562   0.188  1.00  0.00           H  
HETATM   42  H   UNL     1       3.746  -0.014   1.333  1.00  0.00           H  
HETATM   43  H   UNL     1       7.397  -0.185  -1.561  1.00  0.00           H  
HETATM   44  H   UNL     1       9.602   2.553  -0.291  1.00  0.00           H  
HETATM   45  H   UNL     1      11.476   0.966   0.347  1.00  0.00           H  
HETATM   46  H   UNL     1      10.245  -0.382   0.609  1.00  0.00           H  
HETATM   47  H   UNL     1       9.517  -0.189  -1.813  1.00  0.00           H  
HETATM   48  H   UNL     1      10.747   1.160  -2.075  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.559   1.307  -0.653  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.405  -1.408   1.571  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.291   0.118   1.993  1.00  0.00           H  
CONECT    1    2    7   29   29                                       
CONECT    2    3    3    1   30                                       
CONECT    3    2    2    4   31                                       
CONECT    4    3    5   28   28                                       
CONECT    5    8    4   32   33                                       
CONECT    6    8    9    9   34                                       
CONECT    7    1                                                      
CONECT    8    5   27    6                                            
CONECT    9   26    6    6   10                                       
CONECT   10    9   11   35   36                                       
CONECT   11   14   10   12                                            
CONECT   12   13   11   37   38                                       
CONECT   13   14   15   12   39                                       
CONECT   14   13   11   40   41                                       
CONECT   15   13   16   42                                            
CONECT   16   17   17   15   18                                       
CONECT   17   16   16                                                 
CONECT   18   19   19   16   22                                       
CONECT   19   20   18   18   43                                       
CONECT   20   19   23   21                                            
CONECT   21   20   22   22                                            
CONECT   22   18   21   21                                            
CONECT   23   24   20   25   44                                       
CONECT   24   23   25   45   46                                       
CONECT   25   23   24   47   48                                       
CONECT   26   27   27    9   49                                       
CONECT   27    8   26   26                                            
CONECT   28    4    4   29   50                                       
CONECT   29    1    1   28   51                                       
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   19                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
