COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.909  -0.729  -0.101  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.546  -0.976  -0.007  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.676   0.052   0.306  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.161   1.328   0.525  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.523   1.579   0.431  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.396   0.551   0.113  1.00  0.00           C  
HETATM    7  O   UNL     1      -6.764  -1.740  -0.408  1.00  0.00           O  
HETATM    8  O   UNL     1      -6.000   2.834   0.647  1.00  0.00           O  
HETATM    9  C   UNL     1      -8.153  -1.413  -0.488  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.412   3.020   0.534  1.00  0.00           C  
HETATM   11 CL   UNL     1      -3.934  -2.577  -0.281  1.00  0.00          Cl  
HETATM   12 CL   UNL     1      -3.066   2.617   0.919  1.00  0.00          Cl  
HETATM   13  C   UNL     1      -2.197  -0.219   0.409  1.00  0.00           C  
HETATM   14  O   UNL     1      -1.587  -0.026  -0.869  1.00  0.00           O  
HETATM   15  C   UNL     1      -0.245  -0.231  -0.950  1.00  0.00           C  
HETATM   16  C   UNL     1       0.428  -0.065  -2.155  1.00  0.00           C  
HETATM   17  N   UNL     1       1.734  -0.273  -2.197  1.00  0.00           N  
HETATM   18  C   UNL     1       2.398  -0.635  -1.110  1.00  0.00           C  
HETATM   19  N   UNL     1       1.789  -0.802   0.054  1.00  0.00           N  
HETATM   20  C   UNL     1       0.486  -0.606   0.171  1.00  0.00           C  
HETATM   21  N   UNL     1       3.767  -0.844  -1.193  1.00  0.00           N  
HETATM   22  C   UNL     1       4.505  -1.114  -0.035  1.00  0.00           C  
HETATM   23  C   UNL     1       5.521  -0.246   0.365  1.00  0.00           C  
HETATM   24  C   UNL     1       6.248  -0.518   1.514  1.00  0.00           C  
HETATM   25  C   UNL     1       5.966  -1.648   2.259  1.00  0.00           C  
HETATM   26  C   UNL     1       4.959  -2.509   1.863  1.00  0.00           C  
HETATM   27  C   UNL     1       4.225  -2.242   0.722  1.00  0.00           C  
HETATM   28  C   UNL     1       3.128  -3.183   0.295  1.00  0.00           C  
HETATM   29  N   UNL     1       5.806   0.898  -0.392  1.00  0.00           N  
HETATM   30  C   UNL     1       7.002   1.508  -0.268  1.00  0.00           C  
HETATM   31  C   UNL     1       7.271   2.795  -1.004  1.00  0.00           C  
HETATM   32  C   UNL     1       8.691   3.273  -0.692  1.00  0.00           C  
HETATM   33  O   UNL     1       7.861   1.021   0.437  1.00  0.00           O  
HETATM   34  H   UNL     1      -7.456   0.745   0.039  1.00  0.00           H  
HETATM   35  H   UNL     1      -8.304  -0.657  -1.259  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.722  -2.308  -0.740  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.491  -1.025   0.473  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.921   2.385   1.258  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.658   4.064   0.729  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.734   2.753  -0.473  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.752   0.466   1.131  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.037  -1.246   0.736  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.108   0.229  -3.045  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.004  -0.744   1.123  1.00  0.00           H  
HETATM   45  H   UNL     1       4.213  -0.804  -2.054  1.00  0.00           H  
HETATM   46  H   UNL     1       7.036   0.152   1.826  1.00  0.00           H  
HETATM   47  H   UNL     1       6.534  -1.859   3.153  1.00  0.00           H  
HETATM   48  H   UNL     1       4.740  -3.388   2.451  1.00  0.00           H  
HETATM   49  H   UNL     1       2.215  -2.948   0.841  1.00  0.00           H  
HETATM   50  H   UNL     1       2.951  -3.072  -0.775  1.00  0.00           H  
HETATM   51  H   UNL     1       3.426  -4.209   0.509  1.00  0.00           H  
HETATM   52  H   UNL     1       5.144   1.251  -1.006  1.00  0.00           H  
HETATM   53  H   UNL     1       7.172   2.628  -2.076  1.00  0.00           H  
HETATM   54  H   UNL     1       6.555   3.553  -0.686  1.00  0.00           H  
HETATM   55  H   UNL     1       8.791   3.440   0.381  1.00  0.00           H  
HETATM   56  H   UNL     1       9.408   2.516  -1.010  1.00  0.00           H  
HETATM   57  H   UNL     1       8.886   4.204  -1.224  1.00  0.00           H  
CONECT    1    6    6    2    7                                       
CONECT    2    3    3    1   11                                       
CONECT    3    4   13    2    2                                       
CONECT    4   12    5    5    3                                       
CONECT    5    8    4    4    6                                       
CONECT    6    5    1    1   34                                       
CONECT    7    1    9                                                 
CONECT    8   10    5                                                 
CONECT    9    7   35   36   37                                       
CONECT   10    8   38   39   40                                       
CONECT   11    2                                                      
CONECT   12    4                                                      
CONECT   13    3   14   41   42                                       
CONECT   14   13   15                                                 
CONECT   15   20   14   16   16                                       
CONECT   16   15   15   17   43                                       
CONECT   17   18   18   16                                            
CONECT   18   19   21   17   17                                       
CONECT   19   20   20   18                                            
CONECT   20   19   19   15   44                                       
CONECT   21   22   18   45                                            
CONECT   22   27   21   23   23                                       
CONECT   23   22   22   24   29                                       
CONECT   24   25   25   23   46                                       
CONECT   25   26   24   24   47                                       
CONECT   26   27   27   25   48                                       
CONECT   27   28   26   26   22                                       
CONECT   28   27   49   50   51                                       
CONECT   29   23   30   52                                            
CONECT   30   29   33   33   31                                       
CONECT   31   30   32   53   54                                       
CONECT   32   31   55   56   57                                       
CONECT   33   30   30                                                 
CONECT   34    6                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   16                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
CONECT   53   31                                                      
CONECT   54   31                                                      
CONECT   55   32                                                      
CONECT   56   32                                                      
CONECT   57   32                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
