# generated using pymatgen data_Ho8Ti9Si16Mo3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.97149465 _cell_length_b 6.97149465 _cell_length_c 12.83229454 _cell_angle_alpha 90.02971771 _cell_angle_beta 89.97028229 _cell_angle_gamma 89.94876703 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho8Ti9Si16Mo3 _chemical_formula_sum 'Ho8 Ti9 Si16 Mo3' _cell_volume 623.67139639 _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 Ho Ho0 1 0.33945083 0.00021205 0.46637591 1.0 Ho Ho1 1 0.49952718 0.84108771 0.71827865 1.0 Ho Ho2 1 0.49892433 0.15869553 0.21631883 1.0 Ho Ho3 1 0.84108771 0.49952718 0.28172135 1.0 Ho Ho4 1 0.15869553 0.49892433 0.78368117 1.0 Ho Ho5 1 0.65985411 0.00138692 0.96681594 1.0 Ho Ho6 1 0.00021205 0.33945083 0.53362409 1.0 Ho Ho7 1 0.00138692 0.65985411 0.03318406 1.0 Ti Ti8 1 0.67271878 0.67271878 0.50000000 1.0 Ti Ti9 1 0.15258152 0.00937400 0.87658142 1.0 Ti Ti10 1 0.49048707 0.65358303 0.12601629 1.0 Ti Ti11 1 0.50931512 0.34611399 0.62840725 1.0 Ti Ti12 1 0.65358303 0.49048707 0.87398371 1.0 Ti Ti13 1 0.34611399 0.50931512 0.37159275 1.0 Ti Ti14 1 0.84856642 0.99164357 0.37542122 1.0 Ti Ti15 1 0.00937400 0.15258152 0.12341858 1.0 Ti Ti16 1 0.99164357 0.84856642 0.62457878 1.0 Si Si17 1 0.20129883 0.13029709 0.68463227 1.0 Si Si18 1 0.37027265 0.70125017 0.93434738 1.0 Si Si19 1 0.63075524 0.29772588 0.43474850 1.0 Si Si20 1 0.70125017 0.37027265 0.06565262 1.0 Si Si21 1 0.29772588 0.63075524 0.56525150 1.0 Si Si22 1 0.79828528 0.86999189 0.18434739 1.0 Si Si23 1 0.13029709 0.20129883 0.31536773 1.0 Si Si24 1 0.86999189 0.79828528 0.81565261 1.0 Si Si25 1 0.29166594 0.95251494 0.06406326 1.0 Si Si26 1 0.54756278 0.79139101 0.31417925 1.0 Si Si27 1 0.45179390 0.20863718 0.81522213 1.0 Si Si28 1 0.79139101 0.54756278 0.68582075 1.0 Si Si29 1 0.20863718 0.45179390 0.18477787 1.0 Si Si30 1 0.70774985 0.04805105 0.56549170 1.0 Si Si31 1 0.95251494 0.29166594 0.93593674 1.0 Si Si32 1 0.04805105 0.70774985 0.43450830 1.0 Mo Mo33 1 0.32657790 0.32657790 0.00000000 1.0 Mo Mo34 1 0.17410728 0.82654798 0.24882656 1.0 Mo Mo35 1 0.82654798 0.17410728 0.75117344 1.0