AB/AB4_tI10_87_a_h.AB params=5.994223495583692,0.3737982159729875,0.9195156532136104,0.7136448752316038 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
  -2.99711174779185   2.99711174779185   1.12031502439627
   2.99711174779185  -2.99711174779185   1.12031502439627
   2.99711174779185   2.99711174779185  -1.12031502439627
C Fe
1 4 
Direct(5) [A1B4] 
   0.00000000000000   0.00000000000000   0.00000000000000  A     
   0.71364487523160   0.91951565321361   0.63316052844521  B     
   0.28635512476840   0.08048434678639   0.36683947155479  B     
   0.91951565321361   0.28635512476840   0.20587077798201  B     
   0.08048434678639   0.71364487523160   0.79412922201799  B