# generated using pymatgen data_Ho4SiI6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.19507385 _cell_length_b 13.96599028 _cell_length_c 14.56168471 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho4SiI6 _chemical_formula_sum 'Ho8 Si2 I12' _cell_volume 853.14523474 _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 0.50000000 0.11704169 0.34972096 1.0 Ho Ho1 1 0.50000000 0.88295831 0.65027904 1.0 Ho Ho2 1 0.50000000 0.61704169 0.15027904 1.0 Ho Ho3 1 0.50000000 0.38295831 0.84972096 1.0 Ho Ho4 1 0.00000000 0.10699094 0.57704062 1.0 Ho Ho5 1 0.00000000 0.89300906 0.42295938 1.0 Ho Ho6 1 0.00000000 0.60699094 0.92295938 1.0 Ho Ho7 1 0.00000000 0.39300906 0.07704062 1.0 Si Si8 1 0.50000000 0.00000000 0.50000000 1.0 Si Si9 1 0.50000000 0.50000000 0.00000000 1.0 I I10 1 0.50000000 0.25519835 0.16990207 1.0 I I11 1 0.50000000 0.74480165 0.83009793 1.0 I I12 1 0.50000000 0.75519835 0.33009793 1.0 I I13 1 0.50000000 0.24480165 0.66990207 1.0 I I14 1 0.00000000 0.25880835 0.42062920 1.0 I I15 1 0.00000000 0.74119165 0.57937080 1.0 I I16 1 0.00000000 0.75880835 0.07937080 1.0 I I17 1 0.00000000 0.24119165 0.92062920 1.0 I I18 1 0.00000000 0.00602824 0.23831769 1.0 I I19 1 0.00000000 0.99397176 0.76168231 1.0 I I20 1 0.00000000 0.50602824 0.26168231 1.0 I I21 1 0.00000000 0.49397176 0.73831769 1.0