# generated using pymatgen data_MgTe4(MoS)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.36004701 _cell_length_b 3.36047697 _cell_length_c 45.04219326 _cell_angle_alpha 89.98752457 _cell_angle_beta 90.00808980 _cell_angle_gamma 119.99541044 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgTe4(MoS)4 _chemical_formula_sum 'Mg1 Te4 Mo4 S4' _cell_volume 440.47017947 _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 0.99975700 0.00091700 0.55319300 1.0 Te Te1 1 0.33340400 0.66669900 0.70613600 1.0 Te Te2 1 0.66662200 0.33342600 0.05193400 1.0 Te Te3 1 0.66665700 0.33321800 0.13587800 1.0 Te Te4 1 0.33335100 0.66704000 0.62198800 1.0 Mo Mo5 1 0.33335000 0.66676900 0.09387800 1.0 Mo Mo6 1 0.33342100 0.66626500 0.46254300 1.0 Mo Mo7 1 0.66665700 0.33325500 0.28166400 1.0 Mo Mo8 1 0.66665500 0.33338600 0.66433500 1.0 S S9 1 0.33336300 0.66650000 0.31529000 1.0 S S10 1 0.66668200 0.33311600 0.42922600 1.0 S S11 1 0.66677800 0.33260600 0.49670900 1.0 S S12 1 0.33330400 0.66680300 0.24805500 1.0