# generated using pymatgen data_Mg3Si4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.97266500 _cell_length_b 6.74247858 _cell_length_c 7.40464020 _cell_angle_alpha 114.51965235 _cell_angle_beta 89.54388159 _cell_angle_gamma 104.46084074 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg3Si4 _chemical_formula_sum 'Mg6 Si8' _cell_volume 261.14926391 _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 0.02415500 0.92006300 0.45932300 1.0 Mg Mg1 1 0.39999500 0.81256400 0.68284600 1.0 Mg Mg2 1 0.62284400 0.59518500 0.93624100 1.0 Mg Mg3 1 0.24587000 0.24890500 0.01087400 1.0 Mg Mg4 1 0.85039800 0.46213500 0.51570400 1.0 Mg Mg5 1 0.18788700 0.79869300 0.05403400 1.0 Si Si6 1 0.20774500 0.40159000 0.70854200 1.0 Si Si7 1 0.81240600 0.21709400 0.75596800 1.0 Si Si8 1 0.88185300 0.47635800 0.15628100 1.0 Si Si9 1 0.54155800 0.59646500 0.30808300 1.0 Si Si10 1 0.88714300 0.89208800 0.81187400 1.0 Si Si11 1 0.34718400 0.24918100 0.38455100 1.0 Si Si12 1 0.58826000 0.99883700 0.38012200 1.0 Si Si13 1 0.65605300 0.07729200 0.08222700 1.0