# generated using pymatgen data_CaHo5(CdHg2)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.04974984 _cell_length_b 7.15122559 _cell_length_c 15.06356702 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00211257 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaHo5(CdHg2)6 _chemical_formula_sum 'Ca1 Ho5 Cd6 Hg12' _cell_volume 543.97402958 _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 0.50016091 0.00000000 0.83333926 1.0 Ho Ho1 1 0.99997237 0.50000100 0.00113630 1.0 Ho Ho2 1 0.49986759 0.00000000 0.16699856 1.0 Ho Ho3 1 0.99984186 0.50000100 0.33328842 1.0 Ho Ho4 1 0.49999519 0.00000000 0.49958201 1.0 Ho Ho5 1 0.00012337 0.50000100 0.66559200 1.0 Cd Cd6 1 0.00000233 0.00000000 0.99844980 1.0 Cd Cd7 1 0.49982307 0.50000100 0.16964032 1.0 Cd Cd8 1 0.99982199 0.00000000 0.33332968 1.0 Cd Cd9 1 0.49998250 0.50000100 0.49703633 1.0 Cd Cd10 1 0.00020630 0.00000000 0.66827424 1.0 Cd Cd11 1 0.50022096 0.50000100 0.83334082 1.0 Hg Hg12 1 0.49997664 0.25142850 0.00164548 1.0 Hg Hg13 1 0.49997664 0.74857150 0.00164548 1.0 Hg Hg14 1 0.99984154 0.24942666 0.16680378 1.0 Hg Hg15 1 0.99984154 0.75057334 0.16680378 1.0 Hg Hg16 1 0.49983116 0.24816298 0.33334780 1.0 Hg Hg17 1 0.49983116 0.75183602 0.33334780 1.0 Hg Hg18 1 0.99999799 0.24936915 0.49984515 1.0 Hg Hg19 1 0.99999799 0.75062985 0.49984515 1.0 Hg Hg20 1 0.50014986 0.25144379 0.66504031 1.0 Hg Hg21 1 0.50014986 0.74855521 0.66504031 1.0 Hg Hg22 1 0.00019008 0.25728644 0.83331510 1.0 Hg Hg23 1 0.00019008 0.74271356 0.83331510 1.0