O  Fe
 1.0000000000000000
     4.2032711140995955    2.2376441116844221    2.3233554199863908
     2.2376441116844221    4.2032711140995955    2.3233554199863908
     2.1592266873017891    2.1592266873017891    4.6099460038514311
 O   Fe 
   2   2
Cartesian
  2.1500354782714526  2.1500354782714517  2.3141642109560534
  6.4501064348143577  6.4501064348143577  6.9424926328681602
  4.3000709565429034  4.3000709565429025  4.6283284219121050
  0.0000000000000000  0.0000000000000000  0.0000000000000000
