# generated using pymatgen
data_LuZrFe4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.05226983
_cell_length_b   5.05226948
_cell_length_c   5.05226977
_cell_angle_alpha   59.99999809
_cell_angle_beta   60.00000044
_cell_angle_gamma   60.00000562
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuZrFe4
_chemical_formula_sum   'Lu1 Zr1 Fe4'
_cell_volume   91.18944905
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Lu  Lu0  1  0.75000000  0.75000000  0.75000000  1.0
  Zr  Zr1  1  0.50000000  0.50000000  0.50000000  1.0
  Fe  Fe2  1  0.12481720  0.12481720  0.12481720  1.0
  Fe  Fe3  1  0.62554739  0.12481720  0.12481720  1.0
  Fe  Fe4  1  0.12481720  0.62554739  0.12481720  1.0
  Fe  Fe5  1  0.12481720  0.12481720  0.62554739  1.0