# generated using pymatgen data_MgTe4Mo3W(SeS)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.39590572 _cell_length_b 3.39593726 _cell_length_c 44.53969940 _cell_angle_alpha 90.71114472 _cell_angle_beta 89.31569514 _cell_angle_gamma 120.00679863 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgTe4Mo3W(SeS)2 _chemical_formula_sum 'Mg1 Te4 Mo3 W1 Se2 S2' _cell_volume 444.75460793 _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 Mg Mg0 1 0.34101100 0.65678800 0.37855900 1.0 Te Te1 1 0.32884500 0.67128900 0.69950600 1.0 Te Te2 1 0.67128700 0.32837600 0.05183500 1.0 Te Te3 1 0.66309200 0.33755400 0.13596000 1.0 Te Te4 1 0.33694400 0.66213200 0.61534000 1.0 Mo Mo5 1 0.33384400 0.66629100 0.09392100 1.0 Mo Mo6 1 0.66617100 0.33357800 0.27719700 1.0 Mo Mo7 1 0.66618000 0.33340500 0.65742800 1.0 W W8 1 0.33919100 0.66004800 0.47744300 1.0 Se Se9 1 0.32905300 0.67114400 0.31436100 1.0 Se Se10 1 0.33647700 0.66285200 0.24023000 1.0 S S11 1 0.67603300 0.32281400 0.44365800 1.0 S S12 1 0.66901300 0.33063500 0.51104000 1.0