# generated using pymatgen data_ErTh3(WC2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.33223495 _cell_length_b 6.76967080 _cell_length_c 10.05786746 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ErTh3(WC2)2 _chemical_formula_sum 'Er2 Th6 W4 C8' _cell_volume 363.06362158 _cell_formula_units_Z 2 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 Er Er0 1 0.25000000 0.32283797 0.44456878 1.0 Er Er1 1 0.75000000 0.17716203 0.94456878 1.0 Th Th2 1 0.25000000 0.46350559 0.78386166 1.0 Th Th3 1 0.75000000 0.03649441 0.28386166 1.0 Th Th4 1 0.25000000 0.96802230 0.71794223 1.0 Th Th5 1 0.75000000 0.53197770 0.21794223 1.0 Th Th6 1 0.25000000 0.81983455 0.04940223 1.0 Th Th7 1 0.75000000 0.68016545 0.54940223 1.0 W W8 1 0.25000000 0.27785614 0.13381745 1.0 W W9 1 0.75000000 0.22214386 0.63381745 1.0 W W10 1 0.25000000 0.77666260 0.36658693 1.0 W W11 1 0.75000000 0.72333740 0.86658693 1.0 C C12 1 0.25000000 0.17131304 0.94648970 1.0 C C13 1 0.75000000 0.83299676 0.05304022 1.0 C C14 1 0.25000000 0.66700324 0.55304022 1.0 C C15 1 0.75000000 0.32868696 0.44648970 1.0 C C16 1 0.25000000 0.04764686 0.26208752 1.0 C C17 1 0.75000000 0.45235314 0.76208752 1.0 C C18 1 0.25000000 0.54047058 0.24220427 1.0 C C19 1 0.75000000 0.95952942 0.74220427 1.0