# generated using pymatgen data_K2Nb3(WSe4)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.93318378 _cell_length_b 5.93318529 _cell_length_c 17.39492620 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000271 _symmetry_Int_Tables_number 1 _chemical_formula_structural K2Nb3(WSe4)3 _chemical_formula_sum 'K2 Nb3 W3 Se12' _cell_volume 530.30890789 _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 K K0 1 0.00000000 0.00000000 0.99923547 1.0 K K1 1 0.00000000 0.00000000 0.50076453 1.0 Nb Nb2 1 0.66666700 0.33333300 0.75000000 1.0 Nb Nb3 1 0.66666700 0.33333300 0.25000000 1.0 Nb Nb4 1 0.33333300 0.66666700 0.75000000 1.0 W W5 1 0.00000000 0.00000000 0.75000000 1.0 W W6 1 0.00000000 0.00000000 0.25000000 1.0 W W7 1 0.33333300 0.66666700 0.25000000 1.0 Se Se8 1 0.32714007 0.99259834 0.15572856 1.0 Se Se9 1 0.00740166 0.33454273 0.15572856 1.0 Se Se10 1 0.66545727 0.67285993 0.15572856 1.0 Se Se11 1 0.32753471 0.32754096 0.65468256 1.0 Se Se12 1 0.66545727 0.67285993 0.34427144 1.0 Se Se13 1 0.67245904 0.99999375 0.65468256 1.0 Se Se14 1 0.00000625 0.67246529 0.65468256 1.0 Se Se15 1 0.00000625 0.67246529 0.84531744 1.0 Se Se16 1 0.32753471 0.32754096 0.84531744 1.0 Se Se17 1 0.00740166 0.33454273 0.34427144 1.0 Se Se18 1 0.32714007 0.99259834 0.34427144 1.0 Se Se19 1 0.67245904 0.99999375 0.84531744 1.0