# generated using pymatgen data_Ca4CdIn3Hg4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.84285061 _cell_length_b 7.60817282 _cell_length_c 8.47892737 _cell_angle_alpha 89.99223095 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca4CdIn3Hg4 _chemical_formula_sum 'Ca4 Cd1 In3 Hg4' _cell_volume 312.40814863 _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 Ca Ca0 1 0.25000000 0.00733827 0.29128954 1.0 Ca Ca1 1 0.75000000 0.49343923 0.78848219 1.0 Ca Ca2 1 0.75000000 0.99691311 0.70854677 1.0 Ca Ca3 1 0.25000000 0.50114796 0.21229330 1.0 Cd Cd4 1 0.75000000 0.30115060 0.41854018 1.0 In In5 1 0.75000000 0.80347242 0.08363902 1.0 In In6 1 0.25000000 0.19466855 0.91546069 1.0 In In7 1 0.25000000 0.69246102 0.58287158 1.0 Hg Hg8 1 0.25000000 0.28898651 0.58704822 1.0 Hg Hg9 1 0.25000000 0.78787882 0.90935825 1.0 Hg Hg10 1 0.75000000 0.71802483 0.41059034 1.0 Hg Hg11 1 0.75000000 0.21451669 0.09188293 1.0