# generated using pymatgen data_SrMgCu2O3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.19098137 _cell_length_b 3.93781328 _cell_length_c 8.20122046 _cell_angle_alpha 118.70564203 _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 90.38709444 _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 0.50000000 0.50000000 0.50000000 1.0 Cu Cu2 1 -0.00000000 0.20962605 0.70729638 1.0 Cu Cu3 1 0.00000000 0.79037395 0.29270362 1.0 O O4 1 -0.00000000 0.69306797 0.69069932 1.0 O O5 1 0.00000000 0.30693203 0.30930068 1.0 O O6 1 0.00000000 0.50000000 -0.00000000 1.0