# generated using pymatgen data_Mg4Si7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.94897900 _cell_length_b 6.91972202 _cell_length_c 14.81888106 _cell_angle_alpha 92.67182902 _cell_angle_beta 97.05650949 _cell_angle_gamma 89.99569436 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg4Si7 _chemical_formula_sum 'Mg8 Si14' _cell_volume 401.42771980 _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 0.50428400 0.81898800 0.07147300 1.0 Mg Mg1 1 0.71594800 0.56212200 0.49400500 1.0 Mg Mg2 1 0.28964800 0.74912400 0.64724600 1.0 Mg Mg3 1 0.13992200 0.36039000 0.34038200 1.0 Mg Mg4 1 0.54835700 0.33678400 0.16639600 1.0 Mg Mg5 1 0.90090400 0.76576400 0.86899300 1.0 Mg Mg6 1 0.25032300 0.26158300 0.57045100 1.0 Mg Mg7 1 0.17744400 0.86184100 0.41772200 1.0 Si Si8 1 0.98507900 0.49603700 0.04454600 1.0 Si Si9 1 0.98682300 0.13655400 0.04156600 1.0 Si Si10 1 0.43545900 0.50161100 0.94421600 1.0 Si Si11 1 0.43694600 0.13802600 0.94649100 1.0 Si Si12 1 0.68924700 0.17890400 0.43929400 1.0 Si Si13 1 0.74720500 0.94319100 0.55274200 1.0 Si Si14 1 0.34454800 0.04275700 0.78690300 1.0 Si Si15 1 0.07180000 0.01908700 0.19672700 1.0 Si Si16 1 0.62216700 0.64837700 0.30569400 1.0 Si Si17 1 0.80898300 0.47287800 0.68826600 1.0 Si Si18 1 0.35126500 0.41979400 0.78341900 1.0 Si Si19 1 0.07061000 0.65688400 0.19700800 1.0 Si Si20 1 0.61661600 0.00787900 0.29399900 1.0 Si Si21 1 0.80645500 0.11773500 0.69881300 1.0