# generated using pymatgen data_BaHgBPt3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.81543507 _cell_length_b 5.81543550 _cell_length_c 7.59297629 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999199 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaHgBPt3 _chemical_formula_sum 'Ba2 Hg2 B2 Pt6' _cell_volume 222.38585730 _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 Ba Ba0 1 0.00000000 0.00000000 0.00000000 1.0 Ba Ba1 1 0.00000000 0.00000000 0.50000000 1.0 Hg Hg2 1 0.66666700 0.33333400 0.50000000 1.0 Hg Hg3 1 0.33333400 0.66666700 0.50000000 1.0 B B4 1 0.66666700 0.33333400 0.00000000 1.0 B B5 1 0.33333400 0.66666700 0.00000000 1.0 Pt Pt6 1 0.50000000 0.00000000 0.18900986 1.0 Pt Pt7 1 0.00000000 0.50000000 0.18900986 1.0 Pt Pt8 1 0.49999900 0.50000000 0.18900986 1.0 Pt Pt9 1 0.50000000 0.00000000 0.81099014 1.0 Pt Pt10 1 0.00000000 0.50000000 0.81099014 1.0 Pt Pt11 1 0.49999900 0.50000000 0.81099014 1.0