# generated using pymatgen data_NaCr2O4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.97350100 _cell_length_b 9.06493400 _cell_length_c 10.61801200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaCr2O4 _chemical_formula_sum 'Na4 Cr8 O16' _cell_volume 286.20416341 _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 Na Na0 1 0.25000000 0.74316600 0.15278800 1.0 Na Na1 1 0.75000000 0.75683400 0.65278800 1.0 Na Na2 1 0.25000000 0.24316600 0.34721200 1.0 Na Na3 1 0.75000000 0.25683400 0.84721200 1.0 Cr Cr4 1 0.25000000 0.56411800 0.38730300 1.0 Cr Cr5 1 0.25000000 0.58057700 0.89507400 1.0 Cr Cr6 1 0.75000000 0.91942300 0.39507400 1.0 Cr Cr7 1 0.75000000 0.93588200 0.88730300 1.0 Cr Cr8 1 0.25000000 0.06411800 0.11269700 1.0 Cr Cr9 1 0.25000000 0.08057700 0.60492600 1.0 Cr Cr10 1 0.75000000 0.41942300 0.10492600 1.0 Cr Cr11 1 0.75000000 0.43588200 0.61269700 1.0 O O12 1 0.75000000 0.52125600 0.78452300 1.0 O O13 1 0.25000000 0.57552600 0.57247200 1.0 O O14 1 0.75000000 0.61275100 0.01764800 1.0 O O15 1 0.75000000 0.70591600 0.35126200 1.0 O O16 1 0.25000000 0.79408400 0.85126200 1.0 O O17 1 0.25000000 0.88724900 0.51764800 1.0 O O18 1 0.75000000 0.92447400 0.07247200 1.0 O O19 1 0.25000000 0.97874400 0.28452300 1.0 O O20 1 0.75000000 0.02125600 0.71547700 1.0 O O21 1 0.25000000 0.07552600 0.92752800 1.0 O O22 1 0.75000000 0.11275100 0.48235200 1.0 O O23 1 0.75000000 0.20591600 0.14873800 1.0 O O24 1 0.25000000 0.29408400 0.64873800 1.0 O O25 1 0.25000000 0.38724900 0.98235200 1.0 O O26 1 0.75000000 0.42447400 0.42752800 1.0 O O27 1 0.25000000 0.47874400 0.21547700 1.0