AB/AB4_tI10_87_a_h.AB params=6.456830190867416,0.4001465873039659,0.28644189482032323,0.9249780462203847 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
  -3.22841509543371   3.22841509543371   1.29183928283841
   3.22841509543371  -3.22841509543371   1.29183928283841
   3.22841509543371   3.22841509543371  -1.29183928283841
C Fe
1 4 
Direct(5) [A1B4] 
   0.00000000000000   0.00000000000000   0.00000000000000  A     
   0.92497804622038   0.28644189482032   0.21141994104071  B     
   0.07502195377962   0.71355810517968   0.78858005895929  B     
   0.28644189482032   0.07502195377962   0.36146384859994  B     
   0.71355810517968   0.92497804622038   0.63853615140006  B