# generated using pymatgen data_Nd3In3CuHg2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.60592888 _cell_length_b 7.60592945 _cell_length_c 4.46532249 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999755 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd3In3CuHg2 _chemical_formula_sum 'Nd3 In3 Cu1 Hg2' _cell_volume 223.71135299 _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 Nd Nd0 1 1.00000000 0.59689512 0.50000000 1.0 Nd Nd1 1 0.40310488 0.40310488 0.50000000 1.0 Nd Nd2 1 0.59689512 0.00000000 0.50000000 1.0 In In3 1 0.76375135 0.76375135 0.00000000 1.0 In In4 1 0.00000000 0.23624865 0.00000000 1.0 In In5 1 0.23624865 0.00000000 0.00000000 1.0 Cu Cu6 1 0.00000000 0.00000000 0.50000000 1.0 Hg Hg7 1 0.33333300 0.66666700 0.00000000 1.0 Hg Hg8 1 0.66666700 0.33333300 0.00000000 1.0