COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.194   1.370   0.074  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.831   1.497   0.330  1.00  0.00           C  
HETATM    3  C   UNL     1       0.287   0.695   0.496  1.00  0.00           C  
HETATM    4  C   UNL     1       1.531   1.141   0.057  1.00  0.00           C  
HETATM    5  C   UNL     1       1.644   2.391  -0.548  1.00  0.00           C  
HETATM    6  C   UNL     1       0.526   3.184  -0.711  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.139   1.684   1.579  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.528   0.804   0.486  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.463   0.770  -0.724  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.745  -1.530   0.199  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.646  -2.839   0.652  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.058  -3.802  -0.145  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.568  -3.463  -1.394  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.666  -2.161  -1.848  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.253  -1.193  -1.056  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.710   2.740  -0.280  1.00  0.00           C  
HETATM   17  C   UNL     1       2.732   0.287   0.233  1.00  0.00           C  
HETATM   18  C   UNL     1       2.682  -0.932   0.806  1.00  0.00           C  
HETATM   19  C   UNL     1       4.953  -0.242   0.067  1.00  0.00           C  
HETATM   20  C   UNL     1       3.996   0.677  -0.184  1.00  0.00           C  
HETATM   21  C   UNL     1       6.379  -0.096  -0.265  1.00  0.00           C  
HETATM   22  N   UNL     1      -4.344  -0.556   1.000  1.00  0.00           N  
HETATM   23  N   UNL     1      -2.083   1.053   0.770  1.00  0.00           N  
HETATM   24  N   UNL     1       7.267  -1.107   0.042  1.00  0.00           N  
HETATM   25  N   UNL     1       6.805   0.992  -0.851  1.00  0.00           N  
HETATM   26  O   UNL     1      -3.118   2.106  -0.887  1.00  0.00           O  
HETATM   27  S   UNL     1       4.232  -1.644   0.845  1.00  0.00           S  
HETATM   28  H   UNL     1       0.194  -0.273   0.966  1.00  0.00           H  
HETATM   29  H   UNL     1       2.608   2.740  -0.890  1.00  0.00           H  
HETATM   30  H   UNL     1       0.616   4.153  -1.180  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.357   2.671   1.171  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.061   1.228   1.939  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.435   1.780   2.405  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.988   0.218  -1.535  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.397   0.279  -0.448  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.672   1.788  -1.051  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.027  -3.105   1.627  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.980  -4.820   0.207  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.109  -4.217  -2.015  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.282  -1.899  -2.823  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.329  -0.176  -1.411  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.582   3.364  -0.410  1.00  0.00           H  
HETATM   43  H   UNL     1       1.784  -1.395   1.189  1.00  0.00           H  
HETATM   44  H   UNL     1       4.196   1.623  -0.664  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.639  -0.779   1.897  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.152   0.518   1.576  1.00  0.00           H  
HETATM   47  H   UNL     1       6.951  -1.914   0.477  1.00  0.00           H  
HETATM   48  H   UNL     1       7.745   1.088  -1.071  1.00  0.00           H  
HETATM   49  H   UNL     1       8.207  -1.010  -0.177  1.00  0.00           H  
CONECT    1   26   26   23    8                                       
CONECT    2    3    3   16   23                                       
CONECT    3    4    2    2   28                                       
CONECT    4   17    5    5    3                                       
CONECT    5    4    4    6   29                                       
CONECT    6    5   16   16   30                                       
CONECT    7    8   31   32   33                                       
CONECT    8    1    9    7   22                                       
CONECT    9    8   34   35   36                                       
CONECT   10   22   11   11   15                                       
CONECT   11   10   10   12   37                                       
CONECT   12   11   13   13   38                                       
CONECT   13   12   12   14   39                                       
CONECT   14   15   15   13   40                                       
CONECT   15   10   14   14   41                                       
CONECT   16    6    6    2   42                                       
CONECT   17   18   18   20    4                                       
CONECT   18   27   17   17   43                                       
CONECT   19   27   21   20   20                                       
CONECT   20   19   19   17   44                                       
CONECT   21   25   25   19   24                                       
CONECT   22    8   10   45                                            
CONECT   23    2    1   46                                            
CONECT   24   21   47   49                                            
CONECT   25   21   21   48                                            
CONECT   26    1    1                                                 
CONECT   27   18   19                                                 
CONECT   28    3                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   18                                                      
CONECT   44   20                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   24                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
