COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.758   2.643   0.574  1.00  0.00           C  
HETATM    2  C   UNL     1       5.675   3.413   1.637  1.00  0.00           C  
HETATM    3  C   UNL     1       5.989   3.448   0.126  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.351  -1.226   1.910  1.00  0.00           C  
HETATM    5  O   UNL     1      -1.858   0.596   0.629  1.00  0.00           O  
HETATM    6  C   UNL     1      -1.750   0.050  -0.451  1.00  0.00           C  
HETATM    7  N   UNL     1      -0.535  -0.331  -0.894  1.00  0.00           N  
HETATM    8  C   UNL     1       0.654  -0.087  -0.074  1.00  0.00           C  
HETATM    9  C   UNL     1       1.870  -0.013  -0.961  1.00  0.00           C  
HETATM   10  N   UNL     1       3.085   0.206  -0.422  1.00  0.00           N  
HETATM   11  C   UNL     1       4.267   0.278  -1.284  1.00  0.00           C  
HETATM   12  C   UNL     1       4.798  -1.134  -1.541  1.00  0.00           C  
HETATM   13  O   UNL     1       3.831  -1.878  -2.286  1.00  0.00           O  
HETATM   14  C   UNL     1       5.350   1.112  -0.597  1.00  0.00           C  
HETATM   15  C   UNL     1       4.866   2.556  -0.452  1.00  0.00           C  
HETATM   16  N   UNL     1       4.237   3.134   1.731  1.00  0.00           N  
HETATM   17  O   UNL     1       2.605   2.322   0.381  1.00  0.00           O  
HETATM   18  O   UNL     1       1.755  -0.150  -2.161  1.00  0.00           O  
HETATM   19  C   UNL     1       0.824  -1.229   0.930  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.247  -2.440   2.835  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.316   0.056   2.745  1.00  0.00           C  
HETATM   22  O   UNL     1      -2.842  -0.174  -1.205  1.00  0.00           O  
HETATM   23  C   UNL     1      -4.117   0.264  -0.665  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.233  -0.074  -1.655  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.556   0.380  -1.094  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.304  -0.476  -0.308  1.00  0.00           C  
HETATM   27  C   UNL     1      -8.516  -0.057   0.212  1.00  0.00           C  
HETATM   28 CL   UNL     1      -9.455  -1.132   1.201  1.00  0.00          Cl  
HETATM   29  C   UNL     1      -8.979   1.218  -0.056  1.00  0.00           C  
HETATM   30  C   UNL     1      -8.231   2.074  -0.843  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.020   1.655  -1.362  1.00  0.00           C  
HETATM   32  S   UNL     1       5.108  -1.961   0.043  1.00  0.00           S  
HETATM   33  H   UNL     1       6.245   2.623   2.125  1.00  0.00           H  
HETATM   34  H   UNL     1       5.902   4.378   2.091  1.00  0.00           H  
HETATM   35  H   UNL     1       5.920   4.464  -0.264  1.00  0.00           H  
HETATM   36  H   UNL     1       6.971   3.021  -0.078  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.288  -1.272   1.354  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.448  -0.767  -1.756  1.00  0.00           H  
HETATM   39  H   UNL     1       0.538   0.854   0.463  1.00  0.00           H  
HETATM   40  H   UNL     1       3.178   0.316   0.538  1.00  0.00           H  
HETATM   41  H   UNL     1       3.997   0.743  -2.232  1.00  0.00           H  
HETATM   42  H   UNL     1       5.727  -1.076  -2.109  1.00  0.00           H  
HETATM   43  H   UNL     1       2.978  -1.970  -1.841  1.00  0.00           H  
HETATM   44  H   UNL     1       5.557   0.698   0.390  1.00  0.00           H  
HETATM   45  H   UNL     1       6.260   1.092  -1.197  1.00  0.00           H  
HETATM   46  H   UNL     1       4.527   2.942  -1.413  1.00  0.00           H  
HETATM   47  H   UNL     1       3.701   3.284   2.525  1.00  0.00           H  
HETATM   48  H   UNL     1       1.755  -1.094   1.480  1.00  0.00           H  
HETATM   49  H   UNL     1       0.851  -2.180   0.398  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.085  -2.438   3.533  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.273  -3.353   2.240  1.00  0.00           H  
HETATM   52  H   UNL     1       0.689  -2.395   3.391  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.390   0.921   2.086  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.153   0.058   3.443  1.00  0.00           H  
HETATM   55  H   UNL     1       0.621   0.101   3.300  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.304  -0.245   0.281  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.091   1.341  -0.499  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.046   0.435  -2.601  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.259  -1.151  -1.820  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.942  -1.472  -0.099  1.00  0.00           H  
HETATM   61  H   UNL     1      -9.925   1.546   0.349  1.00  0.00           H  
HETATM   62  H   UNL     1      -8.592   3.070  -1.052  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.433   2.325  -1.973  1.00  0.00           H  
HETATM   64  O   UNL     1       3.884  -2.223   0.717  1.00  0.00           O  
HETATM   65  O   UNL     1       5.626  -3.339  -0.343  1.00  0.00           O  
HETATM   66  O   UNL     1       6.200  -1.353   0.718  1.00  0.00           O  
HETATM   67  H   UNL     1       5.838  -3.906   0.412  1.00  0.00           H  
CONECT    1   15   17   17   16                                       
CONECT    2    3   16   33   34                                       
CONECT    3   15    2   35   36                                       
CONECT    4   20   21   19   37                                       
CONECT    5    6    6                                                 
CONECT    6    7   22    5    5                                       
CONECT    7    8    6   38                                            
CONECT    8   19    7    9   39                                       
CONECT    9    8   18   18   10                                       
CONECT   10    9   11   40                                            
CONECT   11   10   12   14   41                                       
CONECT   12   13   32   11   42                                       
CONECT   13   12   43                                                 
CONECT   14   11   15   44   45                                       
CONECT   15   14    3    1   46                                       
CONECT   16    2    1   47                                            
CONECT   17    1    1                                                 
CONECT   18    9    9                                                 
CONECT   19    4    8   48   49                                       
CONECT   20    4   50   51   52                                       
CONECT   21    4   53   54   55                                       
CONECT   22    6   23                                                 
CONECT   23   22   24   56   57                                       
CONECT   24   25   23   58   59                                       
CONECT   25   26   26   31   24                                       
CONECT   26   27   25   25   60                                       
CONECT   27   28   29   29   26                                       
CONECT   28   27                                                      
CONECT   29   27   27   30   61                                       
CONECT   30   29   31   31   62                                       
CONECT   31   30   30   25   63                                       
CONECT   32   12   64   64   65                                       
CONECT   32   66   66                                                 
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   19                                                      
CONECT   49   19                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   20                                                      
CONECT   53   21                                                      
CONECT   54   21                                                      
CONECT   55   21                                                      
CONECT   56   23                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   24                                                      
CONECT   60   26                                                      
CONECT   61   29                                                      
CONECT   62   30                                                      
CONECT   63   31                                                      
CONECT   64   32   32                                                 
CONECT   65   32   67                                                 
CONECT   66   32   32                                                 
CONECT   67   65                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
