# generated using pymatgen data_Ho4Tm16(HgBi3)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.09882224 _cell_length_b 9.27660163 _cell_length_c 11.91588163 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.09835451 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho4Tm16(HgBi3)3 _chemical_formula_sum 'Ho4 Tm16 Hg3 Bi9' _cell_volume 895.23347635 _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 0.32087029 0.25000000 0.21077983 1.0 Ho Ho1 1 0.80744731 0.25000000 0.28057224 1.0 Ho Ho2 1 0.67892760 0.75000000 0.78727583 1.0 Ho Ho3 1 0.18155957 0.75000000 0.71255974 1.0 Tm Tm4 1 0.34445276 0.75000000 0.20661211 1.0 Tm Tm5 1 0.85461951 0.75000000 0.29259164 1.0 Tm Tm6 1 0.65218318 0.25000000 0.79242214 1.0 Tm Tm7 1 0.15478631 0.25000000 0.71515878 1.0 Tm Tm8 1 0.68684205 0.55972103 0.05958175 1.0 Tm Tm9 1 0.18994895 0.93004406 0.44078557 1.0 Tm Tm10 1 0.31360575 0.06042242 0.94325874 1.0 Tm Tm11 1 0.80705133 0.44637140 0.56283591 1.0 Tm Tm12 1 0.31360575 0.43957758 0.94325874 1.0 Tm Tm13 1 0.80705133 0.05362860 0.56283591 1.0 Tm Tm14 1 0.68684205 0.94027897 0.05958175 1.0 Tm Tm15 1 0.18994895 0.56995594 0.44078557 1.0 Tm Tm16 1 0.47727485 0.25000000 0.49088829 1.0 Tm Tm17 1 0.96521438 0.25000000 0.00813146 1.0 Tm Tm18 1 0.53702971 0.75000000 0.50728585 1.0 Tm Tm19 1 0.03561036 0.75000000 0.99147685 1.0 Hg Hg20 1 0.40768499 0.75000000 0.96343126 1.0 Hg Hg21 1 0.90756657 0.75000000 0.53766012 1.0 Hg Hg22 1 0.59500838 0.25000000 0.03602950 1.0 Bi Bi23 1 0.09111158 0.25000000 0.45873204 1.0 Bi Bi24 1 0.55525094 0.99785579 0.32338479 1.0 Bi Bi25 1 0.05649106 0.50071620 0.17602893 1.0 Bi Bi26 1 0.44147152 0.49753957 0.67552483 1.0 Bi Bi27 1 0.94366472 0.00147397 0.82279715 1.0 Bi Bi28 1 0.44147152 0.00246043 0.67552483 1.0 Bi Bi29 1 0.94366472 0.49852603 0.82279715 1.0 Bi Bi30 1 0.55525094 0.50214421 0.32338479 1.0 Bi Bi31 1 0.05649106 0.99928380 0.17602893 1.0