COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.543   0.875   4.009  1.00  0.00           C  
HETATM    2  C   UNL     1       0.806  -0.175   3.186  1.00  0.00           C  
HETATM    3  C   UNL     1       0.628  -0.640   5.915  1.00  0.00           C  
HETATM    4  C   UNL     1       0.904  -1.700   5.034  1.00  0.00           C  
HETATM    5  C   UNL     1       0.989  -1.459   3.697  1.00  0.00           C  
HETATM    6  C   UNL     1       0.442   0.665   5.395  1.00  0.00           C  
HETATM    7 CL   UNL     1       0.150  -0.060   9.837  1.00  0.00          Cl  
HETATM    8  C   UNL     1       0.167   1.725   6.276  1.00  0.00           C  
HETATM    9  C   UNL     1       0.533  -0.849   7.301  1.00  0.00           C  
HETATM   10  C   UNL     1       0.083   1.486   7.613  1.00  0.00           C  
HETATM   11  C   UNL     1       0.265   0.201   8.125  1.00  0.00           C  
HETATM   12  S   UNL     1       0.924   0.091   1.448  1.00  0.00           S  
HETATM   13  O   UNL     1       1.703  -0.985   0.945  1.00  0.00           O  
HETATM   14  C   UNL     1      -1.852   1.208  -0.793  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.529   1.014   0.689  1.00  0.00           C  
HETATM   16  N   UNL     1      -0.591  -0.113   0.812  1.00  0.00           N  
HETATM   17  C   UNL     1      -1.787  -1.256  -0.954  1.00  0.00           C  
HETATM   18  O   UNL     1      -2.041  -2.244  -1.611  1.00  0.00           O  
HETATM   19  C   UNL     1      -1.054  -1.429   0.347  1.00  0.00           C  
HETATM   20  N   UNL     1      -2.163  -0.066  -1.424  1.00  0.00           N  
HETATM   21  O   UNL     1       1.226   1.470   1.289  1.00  0.00           O  
HETATM   22  C   UNL     1      -2.950  -0.040  -2.660  1.00  0.00           C  
HETATM   23  C   UNL     1       3.497   1.016  -7.007  1.00  0.00           C  
HETATM   24  N   UNL     1       0.745  -0.025  -4.812  1.00  0.00           N  
HETATM   25  C   UNL     1       1.632   0.030  -5.883  1.00  0.00           C  
HETATM   26  C   UNL     1       2.639   0.995  -5.928  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.168  -1.140  -5.080  1.00  0.00           C  
HETATM   28  C   UNL     1       1.542  -0.880  -6.935  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.046   1.208  -4.856  1.00  0.00           C  
HETATM   30  C   UNL     1      -2.008   0.027  -3.863  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.826   0.192  -5.146  1.00  0.00           C  
HETATM   32  O   UNL     1      -3.652   1.352  -5.037  1.00  0.00           O  
HETATM   33  C   UNL     1      -1.184  -1.262  -3.943  1.00  0.00           C  
HETATM   34  N   UNL     1       3.376   0.140  -7.987  1.00  0.00           N  
HETATM   35  C   UNL     1       2.437  -0.787  -7.980  1.00  0.00           C  
HETATM   36  C   UNL     1      -1.055   1.216  -3.706  1.00  0.00           C  
HETATM   37  H   UNL     1       0.408   1.865   3.599  1.00  0.00           H  
HETATM   38  H   UNL     1       1.047  -2.700   5.416  1.00  0.00           H  
HETATM   39  H   UNL     1       1.200  -2.275   3.023  1.00  0.00           H  
HETATM   40  H   UNL     1       0.023   2.725   5.893  1.00  0.00           H  
HETATM   41  H   UNL     1       0.672  -1.838   7.712  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.128   2.302   8.287  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.992   1.655  -1.292  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.708   1.875  -0.889  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.070   1.919   1.087  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.444   0.793   1.239  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.197  -2.087   0.202  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.728  -1.861   1.087  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.600   0.834  -2.658  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.557  -0.943  -2.723  1.00  0.00           H  
HETATM   51  H   UNL     1       4.280   1.760  -7.051  1.00  0.00           H  
HETATM   52  H   UNL     1       2.744   1.715  -5.130  1.00  0.00           H  
HETATM   53  H   UNL     1       0.401  -2.066  -5.157  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.694  -0.961  -6.018  1.00  0.00           H  
HETATM   55  H   UNL     1       0.777  -1.642  -6.936  1.00  0.00           H  
HETATM   56  H   UNL     1       0.617   2.068  -4.762  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.578   1.263  -5.805  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.452  -0.687  -5.293  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.151   0.304  -5.995  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.150   1.419  -5.864  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.659  -1.417  -3.000  1.00  0.00           H  
HETATM   62  H   UNL     1      -1.847  -2.106  -4.135  1.00  0.00           H  
HETATM   63  H   UNL     1       2.371  -1.484  -8.802  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.625   2.145  -3.728  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.526   1.136  -2.756  1.00  0.00           H  
CONECT    1    2    6    6   37                                       
CONECT    2    1    5    5   12                                       
CONECT    3    4    4    6    9                                       
CONECT    4    3    3    5   38                                       
CONECT    5    2    2    4   39                                       
CONECT    6    1    1    3    8                                       
CONECT    7   11                                                      
CONECT    8    6   10   10   40                                       
CONECT    9    3   11   11   41                                       
CONECT   10    8    8   11   42                                       
CONECT   11    7    9    9   10                                       
CONECT   12    2   13   13   16                                       
CONECT   12   21   21                                                 
CONECT   13   12   12                                                 
CONECT   14   15   20   43   44                                       
CONECT   15   14   16   45   46                                       
CONECT   16   12   15   19                                            
CONECT   17   18   18   19   20                                       
CONECT   18   17   17                                                 
CONECT   19   16   17   47   48                                       
CONECT   20   14   17   22                                            
CONECT   21   12   12                                                 
CONECT   22   20   30   49   50                                       
CONECT   23   26   26   34   51                                       
CONECT   24   25   27   29                                            
CONECT   25   24   26   28   28                                       
CONECT   26   23   23   25   52                                       
CONECT   27   24   33   53   54                                       
CONECT   28   25   25   35   55                                       
CONECT   29   24   36   56   57                                       
CONECT   30   22   31   33   36                                       
CONECT   31   30   32   58   59                                       
CONECT   32   31   60                                                 
CONECT   33   27   30   61   62                                       
CONECT   34   23   35   35                                            
CONECT   35   28   34   34   63                                       
CONECT   36   29   30   64   65                                       
CONECT   37    1                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   22                                                      
CONECT   50   22                                                      
CONECT   51   23                                                      
CONECT   52   26                                                      
CONECT   53   27                                                      
CONECT   54   27                                                      
CONECT   55   28                                                      
CONECT   56   29                                                      
CONECT   57   29                                                      
CONECT   58   31                                                      
CONECT   59   31                                                      
CONECT   60   32                                                      
CONECT   61   33                                                      
CONECT   62   33                                                      
CONECT   63   35                                                      
CONECT   64   36                                                      
CONECT   65   36                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
