# generated using pymatgen data_Mg4Si7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.91522200 _cell_length_b 7.16829325 _cell_length_c 14.17138577 _cell_angle_alpha 80.84907220 _cell_angle_beta 89.37420659 _cell_angle_gamma 87.12344136 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg4Si7 _chemical_formula_sum 'Mg8 Si14' _cell_volume 392.16801038 _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 0.00000000 0.00000000 0.00000000 1.0 Mg Mg1 1 0.50000000 0.50000000 0.50000000 1.0 Mg Mg2 1 0.99618700 0.26256700 0.65995400 1.0 Mg Mg3 1 0.00381300 0.73743300 0.34004600 1.0 Mg Mg4 1 0.53083200 0.79915500 0.15435700 1.0 Mg Mg5 1 0.46916800 0.20084500 0.84564300 1.0 Mg Mg6 1 0.00619000 0.78737400 0.57880000 1.0 Mg Mg7 1 0.99381000 0.21262600 0.42120000 1.0 Si Si8 1 0.44318200 0.25305400 0.04981800 1.0 Si Si9 1 0.55681800 0.74694600 0.95018200 1.0 Si Si10 1 0.91644600 0.38645900 0.95308400 1.0 Si Si11 1 0.08355400 0.61354100 0.04691600 1.0 Si Si12 1 0.49939800 0.89125500 0.44313200 1.0 Si Si13 1 0.50060200 0.10874500 0.55686800 1.0 Si Si14 1 0.01274500 0.90300000 0.81516400 1.0 Si Si15 1 0.98725500 0.09700000 0.18483600 1.0 Si Si16 1 0.49371300 0.45057200 0.30518900 1.0 Si Si17 1 0.50628700 0.54942800 0.69481100 1.0 Si Si18 1 0.99446300 0.56305500 0.79747000 1.0 Si Si19 1 0.00553700 0.43694500 0.20253000 1.0 Si Si20 1 0.48455300 0.08770200 0.29056800 1.0 Si Si21 1 0.51544700 0.91229800 0.70943200 1.0