# generated using pymatgen data_Tb5AsS4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.86367500 _cell_length_b 6.86367914 _cell_length_c 6.86367886 _cell_angle_alpha 99.54110754 _cell_angle_beta 99.54076420 _cell_angle_gamma 131.95121626 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb5AsS4 _chemical_formula_sum 'Tb5 As1 S4' _cell_volume 219.64636226 _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 Tb Tb0 1 0.39871348 0.80164989 0.20036437 1.0 Tb Tb1 1 0.00000000 0.00000000 0.00000000 1.0 Tb Tb2 1 0.60128652 0.19835011 0.79963563 1.0 Tb Tb3 1 0.19835011 0.39871548 0.59706359 1.0 Tb Tb4 1 0.80164989 0.60128452 0.40293641 1.0 As As5 1 0.50000000 0.50000000 0.00000000 1.0 S S6 1 0.10082316 0.69934944 0.80017160 1.0 S S7 1 0.69934944 0.89917884 0.59852728 1.0 S S8 1 0.30065056 0.10082116 0.40147272 1.0 S S9 1 0.89917684 0.30065056 0.19982840 1.0