# generated using pymatgen data_MgSi2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.88028800 _cell_length_b 6.25299000 _cell_length_c 9.27770273 _cell_angle_alpha 77.70459890 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgSi2 _chemical_formula_sum 'Mg4 Si8' _cell_volume 219.94524055 _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 Mg Mg0 1 0.50000000 0.10924600 0.83206500 1.0 Mg Mg1 1 0.50000000 0.36229100 0.14316900 1.0 Mg Mg2 1 0.00000000 0.60505300 0.33802100 1.0 Mg Mg3 1 0.00000000 0.84430300 0.65162300 1.0 Si Si4 1 0.50000000 0.83372400 0.16579800 1.0 Si Si5 1 0.00000000 0.68490300 0.98077100 1.0 Si Si6 1 0.50000000 0.52353700 0.59750100 1.0 Si Si7 1 0.00000000 0.16540500 0.37655600 1.0 Si Si8 1 0.50000000 0.61713200 0.84028900 1.0 Si Si9 1 0.00000000 0.04559800 0.05483500 1.0 Si Si10 1 0.50000000 0.92421500 0.41045600 1.0 Si Si11 1 0.00000000 0.28461200 0.60920600 1.0