# generated using pymatgen data_Pr3Sn3Hg2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.66549838 _cell_length_b 6.66549805 _cell_length_c 10.29498630 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 103.19588883 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr3Sn3Hg2 _chemical_formula_sum 'Pr6 Sn6 Hg4' _cell_volume 445.31719848 _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 Pr Pr0 1 0.63516275 0.63516275 0.25000000 1.0 Pr Pr1 1 0.36483725 0.36483725 0.75000000 1.0 Pr Pr2 1 0.20409598 0.79590402 0.50000000 1.0 Pr Pr3 1 0.20409598 0.79590402 0.00000000 1.0 Pr Pr4 1 0.79590402 0.20409598 0.50000000 1.0 Pr Pr5 1 0.79590402 0.20409598 0.00000000 1.0 Sn Sn6 1 0.02013787 0.02013787 0.25000000 1.0 Sn Sn7 1 0.97986213 0.97986213 0.75000000 1.0 Sn Sn8 1 0.48607510 0.06828184 0.25000000 1.0 Sn Sn9 1 0.93171816 0.51392490 0.75000000 1.0 Sn Sn10 1 0.51392490 0.93171816 0.75000000 1.0 Sn Sn11 1 0.06828184 0.48607510 0.25000000 1.0 Hg Hg12 1 0.31140164 0.31140164 0.04699348 1.0 Hg Hg13 1 0.68859836 0.68859836 0.95300652 1.0 Hg Hg14 1 0.31140164 0.31140164 0.45300652 1.0 Hg Hg15 1 0.68859836 0.68859836 0.54699348 1.0