COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.795   1.497  -3.073  1.00  0.00           O  
HETATM    2  C   UNL     1      -5.251   1.706  -1.828  1.00  0.00           C  
HETATM    3  O   UNL     1      -5.437   2.833  -1.435  1.00  0.00           O  
HETATM    4  C   UNL     1      -5.531   0.535  -0.922  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.029   1.038   0.409  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.215   0.564   0.937  1.00  0.00           C  
HETATM    7  N   UNL     1      -7.657   0.999   2.100  1.00  0.00           N  
HETATM    8  C   UNL     1      -6.993   1.896   2.803  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.800   2.415   2.339  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.301   1.978   1.121  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.265  -0.256  -0.717  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.257  -1.619  -0.946  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.096  -2.345  -0.758  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.109   0.382  -0.307  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.948  -0.343  -0.120  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.942  -1.708  -0.342  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.676  -2.499  -0.138  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.585  -3.764  -1.012  1.00  0.00           C  
HETATM   19  O   UNL     1      -0.097  -4.414   0.179  1.00  0.00           O  
HETATM   20  C   UNL     1      -0.732  -3.463   1.062  1.00  0.00           C  
HETATM   21  N   UNL     1       0.530  -1.668  -0.174  1.00  0.00           N  
HETATM   22  C   UNL     1       1.743  -2.233  -0.006  1.00  0.00           C  
HETATM   23  O   UNL     1       1.844  -3.442   0.083  1.00  0.00           O  
HETATM   24  C   UNL     1       2.943  -1.388   0.069  1.00  0.00           C  
HETATM   25  C   UNL     1       2.972  -0.042  -0.118  1.00  0.00           C  
HETATM   26  N   UNL     1       4.221  -1.834   0.347  1.00  0.00           N  
HETATM   27  C   UNL     1       4.600  -3.224   0.613  1.00  0.00           C  
HETATM   28  C   UNL     1       5.079  -0.758   0.332  1.00  0.00           C  
HETATM   29  C   UNL     1       6.449  -0.632   0.542  1.00  0.00           C  
HETATM   30  C   UNL     1       7.046   0.606   0.460  1.00  0.00           C  
HETATM   31  C   UNL     1       4.312   0.387   0.041  1.00  0.00           C  
HETATM   32  C   UNL     1       4.937   1.640  -0.036  1.00  0.00           C  
HETATM   33 CL   UNL     1       4.003   3.059  -0.390  1.00  0.00          Cl  
HETATM   34  C   UNL     1       6.295   1.738   0.170  1.00  0.00           C  
HETATM   35 CL   UNL     1       7.071   3.287   0.072  1.00  0.00          Cl  
HETATM   36  H   UNL     1      -4.630   2.279  -3.618  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.289  -0.103  -1.376  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.787  -0.171   0.389  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.387   2.228   3.752  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.261   3.149   2.919  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.368   2.363   0.736  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.159  -2.118  -1.270  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.090  -3.411  -0.936  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.114   1.448  -0.133  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.045   0.155   0.201  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.552  -4.136  -1.352  1.00  0.00           H  
HETATM   47  H   UNL     1       0.151  -3.696  -1.813  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.110  -3.157   1.903  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.743  -3.743   1.356  1.00  0.00           H  
HETATM   50  H   UNL     1       0.457  -0.712  -0.318  1.00  0.00           H  
HETATM   51  H   UNL     1       2.125   0.588  -0.346  1.00  0.00           H  
HETATM   52  H   UNL     1       4.938  -3.692  -0.312  1.00  0.00           H  
HETATM   53  H   UNL     1       5.406  -3.246   1.347  1.00  0.00           H  
HETATM   54  H   UNL     1       3.739  -3.767   1.002  1.00  0.00           H  
HETATM   55  H   UNL     1       7.043  -1.505   0.768  1.00  0.00           H  
HETATM   56  H   UNL     1       8.110   0.698   0.624  1.00  0.00           H  
CONECT    1    2   36                                                 
CONECT    2    3    3    4    1                                       
CONECT    3    2    2                                                 
CONECT    4    5    2   11   37                                       
CONECT    5    6    4   10   10                                       
CONECT    6    7    7    5   38                                       
CONECT    7    6    6    8                                            
CONECT    8    7    9    9   39                                       
CONECT    9    8    8   10   40                                       
CONECT   10    5    5    9   41                                       
CONECT   11    4   14   14   12                                       
CONECT   12   11   13   13   42                                       
CONECT   13   12   12   16   43                                       
CONECT   14   11   11   15   44                                       
CONECT   15   14   16   16   45                                       
CONECT   16   15   15   13   17                                       
CONECT   17   16   20   21   18                                       
CONECT   18   17   19   46   47                                       
CONECT   19   20   18                                                 
CONECT   20   17   19   48   49                                       
CONECT   21   22   17   50                                            
CONECT   22   23   23   24   21                                       
CONECT   23   22   22                                                 
CONECT   24   22   26   25   25                                       
CONECT   25   24   24   31   51                                       
CONECT   26   27   24   28                                            
CONECT   27   26   52   53   54                                       
CONECT   28   26   29   29   31                                       
CONECT   29   28   28   30   55                                       
CONECT   30   29   34   34   56                                       
CONECT   31   28   25   32   32                                       
CONECT   32   31   31   34   33                                       
CONECT   33   32                                                      
CONECT   34   30   30   32   35                                       
CONECT   35   34                                                      
CONECT   36    1                                                      
CONECT   37    4                                                      
CONECT   38    6                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   18                                                      
CONECT   47   18                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   21                                                      
CONECT   51   25                                                      
CONECT   52   27                                                      
CONECT   53   27                                                      
CONECT   54   27                                                      
CONECT   55   29                                                      
CONECT   56   30                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
