# generated using pymatgen data_LuThReC2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.20942207 _cell_length_b 6.65274292 _cell_length_c 9.73367799 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LuThReC2 _chemical_formula_sum 'Lu4 Th4 Re4 C8' _cell_volume 337.33955052 _cell_formula_units_Z 4 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 Lu Lu0 1 0.25000000 0.83158968 0.94610389 1.0 Lu Lu1 1 0.25000000 0.33158968 0.55389611 1.0 Lu Lu2 1 0.75000000 0.16841032 0.05389611 1.0 Lu Lu3 1 0.75000000 0.66841032 0.44610389 1.0 Th Th4 1 0.25000000 0.46672303 0.21208803 1.0 Th Th5 1 0.25000000 0.96672303 0.28791197 1.0 Th Th6 1 0.75000000 0.53327697 0.78791197 1.0 Th Th7 1 0.75000000 0.03327697 0.71208803 1.0 Re Re8 1 0.25000000 0.27080501 0.86369103 1.0 Re Re9 1 0.25000000 0.77080501 0.63630897 1.0 Re Re10 1 0.75000000 0.72919499 0.13630897 1.0 Re Re11 1 0.75000000 0.22919499 0.36369103 1.0 C C12 1 0.25000000 0.04156219 0.73683165 1.0 C C13 1 0.25000000 0.54156219 0.76316835 1.0 C C14 1 0.75000000 0.95843781 0.26316835 1.0 C C15 1 0.75000000 0.45843781 0.23683165 1.0 C C16 1 0.25000000 0.66284281 0.44817050 1.0 C C17 1 0.25000000 0.16284281 0.05182950 1.0 C C18 1 0.75000000 0.33715719 0.55182950 1.0 C C19 1 0.75000000 0.83715719 0.94817050 1.0