# generated using pymatgen data_Zr10Cu2HgBi5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.74826034 _cell_length_b 8.76339252 _cell_length_c 5.89563008 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.94289973 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr10Cu2HgBi5 _chemical_formula_sum 'Zr10 Cu2 Hg1 Bi5' _cell_volume 391.65566922 _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 Zr Zr0 1 0.73568694 1.00000000 0.25000000 1.0 Zr Zr1 1 0.00829770 0.74507279 0.25000000 1.0 Zr Zr2 1 0.26322491 0.25492721 0.25000000 1.0 Zr Zr3 1 0.25273214 0.00000000 0.75000000 1.0 Zr Zr4 1 0.99824842 0.25472513 0.75000000 1.0 Zr Zr5 1 0.74352329 0.74527487 0.75000000 1.0 Zr Zr6 1 0.33314270 0.66737619 0.49790060 1.0 Zr Zr7 1 0.66576752 0.33262381 0.49790060 1.0 Zr Zr8 1 0.66576752 0.33262381 0.00209940 1.0 Zr Zr9 1 0.33314270 0.66737619 0.00209940 1.0 Cu Cu10 1 0.00007838 0.00000000 0.48906169 1.0 Cu Cu11 1 0.00007838 0.00000000 0.01093831 1.0 Hg Hg12 1 0.38815747 0.00000000 0.25000000 1.0 Bi Bi13 1 0.00134209 0.38426117 0.25000000 1.0 Bi Bi14 1 0.61708093 0.61573883 0.25000000 1.0 Bi Bi15 1 0.60698813 1.00000000 0.75000000 1.0 Bi Bi16 1 0.00007996 0.61342013 0.75000000 1.0 Bi Bi17 1 0.38665982 0.38657987 0.75000000 1.0