# generated using pymatgen data_MgTe4(MoS)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.39379000 _cell_length_b 3.39374820 _cell_length_c 38.28533100 _cell_angle_alpha 90.00024162 _cell_angle_beta 90.00014984 _cell_angle_gamma 120.00093364 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgTe4(MoS)4 _chemical_formula_sum 'Mg1 Te4 Mo4 S4' _cell_volume 381.87702768 _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 0.00000000 0.99999900 0.37514900 1.0 Te Te1 1 0.33335400 0.66670700 0.70658900 1.0 Te Te2 1 0.66664400 0.33328900 0.04490600 1.0 Te Te3 1 0.66664100 0.33328100 0.14288200 1.0 Te Te4 1 0.33335500 0.66671100 0.60854900 1.0 Mo Mo5 1 0.33331200 0.66662100 0.09389100 1.0 Mo Mo6 1 0.33330300 0.66661500 0.47063600 1.0 Mo Mo7 1 0.66668300 0.33336800 0.28066800 1.0 Mo Mo8 1 0.66669300 0.33338900 0.65757100 1.0 S S9 1 0.33336400 0.66672800 0.32231700 1.0 S S10 1 0.66665100 0.33329200 0.42923700 1.0 S S11 1 0.66665000 0.33329700 0.50917300 1.0 S S12 1 0.33335200 0.66670300 0.24218100 1.0