AB/AB4_tI10_87_a_h.AB params=4.252424743743629,0.35700377487865315,0.09284991017182993,0.29046418914817296 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
  -2.12621237187181   2.12621237187181   0.75906584295193
   2.12621237187181  -2.12621237187181   0.75906584295193
   2.12621237187181   2.12621237187181  -0.75906584295193
C Fe
1 4 
Direct(5) [A1B4] 
   0.00000000000000   0.00000000000000   0.00000000000000  A     
   0.29046418914817   0.09284991017183   0.38331409932000  B     
   0.70953581085183   0.90715008982817   0.61668590068000  B     
   0.09284991017183   0.70953581085183   0.80238572102366  B     
   0.90715008982817   0.29046418914817   0.19761427897634  B