# generated using pymatgen data_Ta3MoS8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.75413566 _cell_length_b 12.75413566 _cell_length_c 5.73543910 _cell_angle_alpha 85.67397375 _cell_angle_beta 85.67397375 _cell_angle_gamma 14.90884675 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta3MoS8 _chemical_formula_sum 'Ta3 Mo1 S8' _cell_volume 239.34137819 _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 Ta Ta0 1 0.37512518 0.37512518 0.54154409 1.0 Ta Ta1 1 0.62499376 0.62499376 0.78776342 1.0 Ta Ta2 1 0.87503636 0.87503636 0.04171722 1.0 Mo Mo3 1 0.12493718 0.12493718 0.29398736 1.0 S S4 1 0.68486028 0.68486028 0.10889659 1.0 S S5 1 0.93708934 0.93708934 0.35419214 1.0 S S6 1 0.18598284 0.18598284 0.60125879 1.0 S S7 1 0.43700786 0.43700786 0.85437276 1.0 S S8 1 0.81302617 0.81302617 0.39593331 1.0 S S9 1 0.06385645 0.06385645 0.64232433 1.0 S S10 1 0.31300197 0.31300197 0.89572135 1.0 S S11 1 0.56498260 0.56498260 0.14898763 1.0