AB/AB4_tI10_87_a_h.AB params=5.088597257441965,0.3727321392363697,0.2800134918645192,0.9162193341136038 SG=87 [ANRL doi: 10.1016/j.commatsci.2017.01.017 (part 1), doi: 10.1016/j.commatsci.2018.10.043 (part 2)]
1.000000
  -2.54429862872098   2.54429862872098   0.94834187073933
   2.54429862872098  -2.54429862872098   0.94834187073933
   2.54429862872098   2.54429862872098  -0.94834187073933
C Fe
1 4 
Direct(5) [A1B4] 
   0.00000000000000   0.00000000000000   0.00000000000000  A     
   0.91621933411360   0.28001349186452   0.19623282597812  B     
   0.08378066588640   0.71998650813548   0.80376717402188  B     
   0.28001349186452   0.08378066588640   0.36379415775092  B     
   0.71998650813548   0.91621933411360   0.63620584224908  B