# generated using pymatgen
data_Li2CrFeO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.87734944
_cell_length_b   5.87734944
_cell_length_c   5.06018446
_cell_angle_alpha   73.45918933
_cell_angle_beta   73.45918933
_cell_angle_gamma   59.72173320
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2CrFeO4
_chemical_formula_sum   'Li4 Cr2 Fe2 O8'
_cell_volume   142.58507010
_cell_formula_units_Z   2
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  0.12580400  0.37599100  0.74536800  1
  Li  Li1  1  0.62400900  0.87419600  0.75463200  1
  Li  Li2  1  0.37599100  0.12580400  0.24536800  1
  Li  Li3  1  0.87419600  0.62400900  0.25463200  1
  Cr  Cr4  1  0.12696000  0.87304000  0.75000000  1
  Cr  Cr5  1  0.87304000  0.12696000  0.25000000  1
  Fe  Fe6  1  0.62389800  0.37610200  0.75000000  1
  Fe  Fe7  1  0.37610200  0.62389800  0.25000000  1
  O  O8  1  0.49007100  0.73199600  0.50632000  1
  O  O9  1  0.98399300  0.24085200  0.51157800  1
  O  O10  1  0.24085200  0.98399300  0.01157800  1
  O  O11  1  0.50992900  0.26800400  0.49368000  1
  O  O12  1  0.01600700  0.75914800  0.48842200  1
  O  O13  1  0.26800400  0.50992900  0.99368000  1
  O  O14  1  0.73199600  0.49007100  0.00632000  1
  O  O15  1  0.75914800  0.01600700  0.98842200  1
