# generated using pymatgen
data_LiCrFeO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.87771600
_cell_length_b   5.87771600
_cell_length_c   8.38030600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCrFeO4
_chemical_formula_sum   'Li4 Cr4 Fe4 O16'
_cell_volume   289.51900181
_cell_formula_units_Z   4
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  0.50000000  0.73152500  0.00000000  1
  Li  Li1  1  0.50000000  0.26847500  0.50000000  1
  Li  Li2  1  0.73152500  0.50000000  0.25000000  1
  Li  Li3  1  0.26847500  0.50000000  0.75000000  1
  Cr  Cr4  1  0.73505900  0.00000000  0.25000000  1
  Cr  Cr5  1  0.00000000  0.73505900  0.00000000  1
  Cr  Cr6  1  0.00000000  0.26494100  0.50000000  1
  Cr  Cr7  1  0.26494100  0.00000000  0.75000000  1
  Fe  Fe8  1  0.75587800  0.75587800  0.62500000  1
  Fe  Fe9  1  0.75587800  0.24412200  0.87500000  1
  Fe  Fe10  1  0.24412200  0.75587800  0.37500000  1
  Fe  Fe11  1  0.24412200  0.24412200  0.12500000  1
  O  O12  1  0.51633100  0.76809400  0.25674200  1
  O  O13  1  0.51633100  0.23190600  0.24325800  1
  O  O14  1  0.76809400  0.51633100  0.99325800  1
  O  O15  1  0.76809400  0.48366900  0.50674200  1
  O  O16  1  0.76649400  0.98101400  0.01245500  1
  O  O17  1  0.76649400  0.01898600  0.48754500  1
  O  O18  1  0.98101400  0.76649400  0.23754500  1
  O  O19  1  0.98101400  0.23350600  0.26245500  1
  O  O20  1  0.01898600  0.76649400  0.76245500  1
  O  O21  1  0.01898600  0.23350600  0.73754500  1
  O  O22  1  0.23350600  0.01898600  0.51245500  1
  O  O23  1  0.23350600  0.98101400  0.98754500  1
  O  O24  1  0.23190600  0.51633100  0.00674200  1
  O  O25  1  0.23190600  0.48366900  0.49325800  1
  O  O26  1  0.48366900  0.76809400  0.74325800  1
  O  O27  1  0.48366900  0.23190600  0.75674200  1
