# generated using pymatgen data_MgTe4MoW3(SeS)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.39166900 _cell_length_b 3.39173415 _cell_length_c 46.08926459 _cell_angle_alpha 90.01548962 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99935482 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgTe4MoW3(SeS)2 _chemical_formula_sum 'Mg1 Te4 Mo1 W3 Se2 S2' _cell_volume 459.16468526 _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 0.99999800 0.99999600 0.37262100 1.0 Te Te1 1 0.33341500 0.66683200 0.69863600 1.0 Te Te2 1 0.66655800 0.33311500 0.05324000 1.0 Te Te3 1 0.66673300 0.33346600 0.13468800 1.0 Te Te4 1 0.33332400 0.66665000 0.61679900 1.0 Mo Mo5 1 0.33331100 0.66662300 0.09396100 1.0 W W6 1 0.33329900 0.66659900 0.47636700 1.0 W W7 1 0.66667800 0.33335500 0.27452500 1.0 W W8 1 0.66670200 0.33340400 0.65770600 1.0 Se Se9 1 0.66646900 0.33293800 0.44015600 1.0 Se Se10 1 0.66682100 0.33364100 0.51230600 1.0 S S11 1 0.33339000 0.66678200 0.30724900 1.0 S S12 1 0.33330000 0.66660200 0.24202400 1.0