# generated using pymatgen
data_Li2CrFeO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.16470861
_cell_length_b   5.16470861
_cell_length_c   5.15235861
_cell_angle_alpha   80.45295403
_cell_angle_beta   80.45295403
_cell_angle_gamma   33.47482031
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2CrFeO4
_chemical_formula_sum   'Li2 Cr1 Fe1 O4'
_cell_volume   74.65955467
_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
  Li  Li0  1  0.74922400  0.74922400  0.25124400  1
  Li  Li1  1  0.25077600  0.25077600  0.74875600  1
  Cr  Cr2  1  0.00000000  0.00000000  0.50000000  1
  Fe  Fe3  1  0.50000000  0.50000000  0.00000000  1
  O  O4  1  0.11427100  0.11427100  0.13018900  1
  O  O5  1  0.88572900  0.88572900  0.86981100  1
  O  O6  1  0.61281000  0.61281000  0.62764900  1
  O  O7  1  0.38719000  0.38719000  0.37235100  1
