AB/AB4_tI10_87_a_h.AB params=5.9409233008441085,0.3874592019451472,0.2885197925947134,0.9155788470352904 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
  -2.97046165042205   2.97046165042205   1.15093270048119
   2.97046165042205  -2.97046165042205   1.15093270048119
   2.97046165042205   2.97046165042205  -1.15093270048119
C Fe
1 4 
Direct(5) [A1B4] 
   0.00000000000000   0.00000000000000   0.00000000000000  A     
   0.91557884703529   0.28851979259471   0.20409863963000  B     
   0.08442115296471   0.71148020740529   0.79590136037000  B     
   0.28851979259471   0.08442115296471   0.37294094555942  B     
   0.71148020740529   0.91557884703529   0.62705905444058  B