# generated using pymatgen data_Ho8Hg3Ir _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.04187425 _cell_length_b 10.04187373 _cell_length_c 7.20389653 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999850 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho8Hg3Ir _chemical_formula_sum 'Ho16 Hg6 Ir2' _cell_volume 629.11152217 _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 Ho Ho0 1 0.17178312 0.82821688 0.51837968 1.0 Ho Ho1 1 0.65643277 0.82821688 0.51837968 1.0 Ho Ho2 1 0.17178312 0.34356723 0.51837968 1.0 Ho Ho3 1 0.82821688 0.17178312 0.01837968 1.0 Ho Ho4 1 0.34356723 0.17178312 0.01837968 1.0 Ho Ho5 1 0.82821688 0.65643277 0.01837968 1.0 Ho Ho6 1 0.33333300 0.66666700 0.82213602 1.0 Ho Ho7 1 0.66666700 0.33333300 0.32213602 1.0 Ho Ho8 1 0.46206118 0.53793882 0.20742454 1.0 Ho Ho9 1 0.07587764 0.53793882 0.20742454 1.0 Ho Ho10 1 0.46206118 0.92412236 0.20742454 1.0 Ho Ho11 1 0.53793882 0.46206118 0.70742454 1.0 Ho Ho12 1 0.92412236 0.46206118 0.70742454 1.0 Ho Ho13 1 0.53793882 0.07587764 0.70742454 1.0 Ho Ho14 1 0.00000000 0.00000000 0.23841226 1.0 Ho Ho15 1 0.00000000 0.00000000 0.73841226 1.0 Hg Hg16 1 0.16749472 0.83250528 0.95138935 1.0 Hg Hg17 1 0.66500857 0.83250528 0.95138935 1.0 Hg Hg18 1 0.16749472 0.33499143 0.95138935 1.0 Hg Hg19 1 0.83250528 0.16749472 0.45138935 1.0 Hg Hg20 1 0.33499143 0.16749472 0.45138935 1.0 Hg Hg21 1 0.83250528 0.66500857 0.45138935 1.0 Ir Ir22 1 0.33333300 0.66666700 0.44489401 1.0 Ir Ir23 1 0.66666700 0.33333300 0.94489401 1.0