# generated using pymatgen data_SrMgCu2O3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.73276457 _cell_length_b 4.00642299 _cell_length_c 6.30395014 _cell_angle_alpha 108.52817023 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural SrMgCu2O3 _chemical_formula_sum 'Sr1 Mg1 Cu2 O3' _cell_volume 137.28363062 _cell_formula_units_Z 1 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 Sr Sr0 1 0.50000000 0.00000000 -0.00000000 1.0 Mg Mg1 1 -0.00000000 0.00000000 -0.00000000 1.0 Cu Cu2 1 -0.00000000 0.33046849 0.66093698 1.0 Cu Cu3 1 0.00000000 0.66953151 0.33906302 1.0 O O4 1 0.00000000 0.83890728 0.67781656 1.0 O O5 1 -0.00000000 0.16109272 0.32218344 1.0 O O6 1 -0.00000000 0.50000000 -0.00000000 1.0