# generated using pymatgen data_Ca10RhAu _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.81894698 _cell_length_b 7.71455712 _cell_length_c 16.24647350 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 89.84087107 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca10RhAu _chemical_formula_sum 'Ca20 Rh2 Au2' _cell_volume 854.64497661 _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 Ca Ca0 1 0.35163831 0.31209742 0.06133076 1.0 Ca Ca1 1 0.64836169 0.68790258 0.93866924 1.0 Ca Ca2 1 0.84773503 0.18707269 0.93812211 1.0 Ca Ca3 1 0.64836169 0.68790258 0.56133076 1.0 Ca Ca4 1 0.15226497 0.81292731 0.06187789 1.0 Ca Ca5 1 0.35163831 0.31209742 0.43866924 1.0 Ca Ca6 1 0.15226497 0.81292731 0.43812211 1.0 Ca Ca7 1 0.84773503 0.18707269 0.56187789 1.0 Ca Ca8 1 0.14272032 0.08757704 0.25000000 1.0 Ca Ca9 1 0.85727968 0.91242296 0.75000000 1.0 Ca Ca10 1 0.66174016 0.39572858 0.75000000 1.0 Ca Ca11 1 0.33825984 0.60427142 0.25000000 1.0 Ca Ca12 1 0.32303812 0.04618700 0.64348455 1.0 Ca Ca13 1 0.67696188 0.95381300 0.35651545 1.0 Ca Ca14 1 0.83178489 0.47252953 0.35613368 1.0 Ca Ca15 1 0.67696188 0.95381300 0.14348455 1.0 Ca Ca16 1 0.16821511 0.52747047 0.64386632 1.0 Ca Ca17 1 0.32303812 0.04618700 0.85651545 1.0 Ca Ca18 1 0.16821511 0.52747047 0.85613368 1.0 Ca Ca19 1 0.83178489 0.47252953 0.14386632 1.0 Rh Rh20 1 0.04033747 0.23842300 0.75000000 1.0 Rh Rh21 1 0.95966253 0.76157700 0.25000000 1.0 Au Au22 1 0.53923818 0.25948902 0.25000000 1.0 Au Au23 1 0.46076182 0.74051098 0.75000000 1.0