AB/AB4_tI10_87_a_h.AB params=5.8307861715380636,0.3825143491749567,0.28968229027773074,0.9135533460866607 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
  -2.91539308576903   2.91539308576903   1.11517968879211
   2.91539308576903  -2.91539308576903   1.11517968879211
   2.91539308576903   2.91539308576903  -1.11517968879211
C Fe
1 4 
Direct(5) [A1B4] 
   0.00000000000000   0.00000000000000   0.00000000000000  A     
   0.91355334608666   0.28968229027773   0.20323563636439  B     
   0.08644665391334   0.71031770972227   0.79676436363561  B     
   0.28968229027773   0.08644665391334   0.37612894419107  B     
   0.71031770972227   0.91355334608666   0.62387105580893  B