Fe S
   1.00000000000000     
   5.2753093428775104   0.0000000000000000   0.0000000000000000
   0.0000000000000000   5.2753093428775104   0.0000000000000000
   0.0000000000000000   0.0000000000000000   5.2753093428775104
Fe S
4  8  
Direct
  0.0000000000000000  0.0000000000000000  0.5000000000000000  
  0.5000000000000000  0.0000000000000000  0.0000000000000000  
  0.0000000000000000  0.5000000000000000  0.0000000000000000  
  0.5000000000000000  0.5000000000000000  0.5000000000000000  
  0.1185091560402682  0.3814908439597318  0.6185091560402682  
  0.8814908889597319  0.6185092000402719  0.3814908439597318  
  0.8814908889597319  0.8814907999597281  0.8814908889597319  
  0.1185091560402682  0.1185091670402727  0.1185092000402719  
  0.3814908439597318  0.6185092000402719  0.1185092000402719  
  0.6185091560402682  0.3814908439597318  0.8814908889597319  
  0.6185091560402682  0.1185091670402727  0.3814908439597318  
  0.3814908439597318  0.8814907999597281  0.6185091560402682  
