# generated using pymatgen data_Mo6PbS8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.60475961 _cell_length_b 6.60475961 _cell_length_c 6.60475991 _cell_angle_alpha 89.12772135 _cell_angle_beta 89.12772135 _cell_angle_gamma 89.12772302 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mo6PbS8 _chemical_formula_sum 'Mo6 Pb1 S8' _cell_volume 288.01928699 _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 Mo Mo0 1 0.43684800 0.77251400 0.58493200 1.0 Mo Mo1 1 0.22748600 0.41506800 0.56315200 1.0 Mo Mo2 1 0.58493200 0.43684800 0.77251400 1.0 Mo Mo3 1 0.56315200 0.22748600 0.41506800 1.0 Mo Mo4 1 0.41506800 0.56315200 0.22748600 1.0 Mo Mo5 1 0.77251400 0.58493200 0.43684800 1.0 Pb Pb6 1 0.00000000 0.00000000 0.00000000 1.0 S S7 1 0.38473500 0.12594900 0.74073900 1.0 S S8 1 0.75526100 0.75526100 0.75526100 1.0 S S9 1 0.25926100 0.61526500 0.87405100 1.0 S S10 1 0.61526500 0.87405100 0.25926100 1.0 S S11 1 0.87405100 0.25926100 0.61526500 1.0 S S12 1 0.74073900 0.38473500 0.12594900 1.0 S S13 1 0.24473900 0.24473900 0.24473900 1.0 S S14 1 0.12594900 0.74073900 0.38473500 1.0