# generated using pymatgen data_MgCr2O5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.44770500 _cell_length_b 4.82368600 _cell_length_c 11.56042300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgCr2O5 _chemical_formula_sum 'Mg2 Cr4 O10' _cell_volume 192.25730646 _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 Mg Mg0 1 0.75000000 0.85074400 0.25000000 1.0 Mg Mg1 1 0.24999900 0.14925500 0.75000000 1.0 Cr Cr2 1 0.24999900 0.41329500 0.09976900 1.0 Cr Cr3 1 0.75000000 0.58670400 0.90023100 1.0 Cr Cr4 1 0.75000000 0.58670400 0.59976900 1.0 Cr Cr5 1 0.24999900 0.41329500 0.40023100 1.0 O O6 1 0.75000000 0.41804500 0.75000000 1.0 O O7 1 0.24999900 0.58195400 0.25000000 1.0 O O8 1 0.75000000 0.56839900 0.07493400 1.0 O O9 1 0.24999900 0.43160200 0.92506500 1.0 O O10 1 0.75000000 0.56839900 0.42506500 1.0 O O11 1 0.24999900 0.43160200 0.57493500 1.0 O O12 1 0.24999900 0.06900000 0.35749900 1.0 O O13 1 0.75000000 0.93100100 0.64250100 1.0 O O14 1 0.75000000 0.93100100 0.85749800 1.0 O O15 1 0.24999900 0.06900000 0.14250200 1.0