# generated using pymatgen data_YCr2O4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.45065776 _cell_length_b 6.45065776 _cell_length_c 6.45065776 _cell_angle_alpha 126.72315348 _cell_angle_beta 126.72315348 _cell_angle_gamma 78.70280137 _symmetry_Int_Tables_number 1 _chemical_formula_structural YCr2O4 _chemical_formula_sum 'Y2 Cr4 O8' _cell_volume 166.89954268 _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 Y Y0 1 0.00000000 0.00000000 0.00000000 1.0 Y Y1 1 0.75000000 0.25000000 0.50000000 1.0 Cr Cr2 1 0.87500000 0.62500000 0.25000000 1.0 Cr Cr3 1 0.37500000 0.62500000 0.75000000 1.0 Cr Cr4 1 0.37500000 0.12500000 0.75000000 1.0 Cr Cr5 1 0.37500000 0.62500000 0.25000000 1.0 O O6 1 0.41565200 0.85594400 0.15956400 1.0 O O7 1 0.69638000 0.25608800 0.84043600 1.0 O O8 1 0.33434800 0.39405600 0.34043600 1.0 O O9 1 0.05362000 0.99391200 0.65956400 1.0 O O10 1 0.00608800 0.66565200 0.05970800 1.0 O O11 1 0.60594400 0.94638000 0.94029200 1.0 O O12 1 0.14405600 0.30362000 0.55970800 1.0 O O13 1 0.74391200 0.58434800 0.44029200 1.0