AB/AB4_tI10_87_a_h.AB params=6.54739390993781,0.4098810089247421,0.07381276098860033,0.28699034829856696 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
  -3.27369695496891   3.27369695496891   1.34182621081651
   3.27369695496891  -3.27369695496891   1.34182621081651
   3.27369695496891   3.27369695496891  -1.34182621081651
C Fe
1 4 
Direct(5) [A1B4] 
   0.00000000000000   0.00000000000000   0.00000000000000  A     
   0.28699034829857   0.07381276098860   0.36080310928717  B     
   0.71300965170143   0.92618723901140   0.63919689071283  B     
   0.07381276098860   0.71300965170143   0.78682241269003  B     
   0.92618723901140   0.28699034829857   0.21317758730997  B