# generated using pymatgen data_Ba2Zn25Pd _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.65680349 _cell_length_b 8.65680439 _cell_length_c 8.65680462 _cell_angle_alpha 60.00000634 _cell_angle_beta 60.00000293 _cell_angle_gamma 60.00000328 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba2Zn25Pd _chemical_formula_sum 'Ba2 Zn25 Pd1' _cell_volume 458.73071782 _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 Ba Ba0 1 0.75000000 0.75000000 0.75000000 1.0 Ba Ba1 1 0.25000000 0.25000000 0.25000000 1.0 Zn Zn2 1 0.43950354 0.79923336 0.56049646 1.0 Zn Zn3 1 0.06000708 0.93999292 0.70297010 1.0 Zn Zn4 1 0.56049646 0.43950354 0.79923336 1.0 Zn Zn5 1 0.79923336 0.56049646 0.43950354 1.0 Zn Zn6 1 0.20076664 0.79923336 0.43950354 1.0 Zn Zn7 1 0.70297010 0.06000708 0.93999292 1.0 Zn Zn8 1 0.43950354 0.56049646 0.20076664 1.0 Zn Zn9 1 0.70297010 0.93999292 0.29702990 1.0 Zn Zn10 1 0.43950354 0.20076664 0.79923336 1.0 Zn Zn11 1 0.93999292 0.70297010 0.06000708 1.0 Zn Zn12 1 0.06000708 0.29702990 0.93999292 1.0 Zn Zn13 1 0.93999292 0.29702990 0.70297010 1.0 Zn Zn14 1 0.70297010 0.29702990 0.06000708 1.0 Zn Zn15 1 0.20076664 0.43950354 0.56049646 1.0 Zn Zn16 1 0.79923336 0.43950354 0.20076664 1.0 Zn Zn17 1 0.29702990 0.70297010 0.93999292 1.0 Zn Zn18 1 0.06000708 0.70297010 0.29702990 1.0 Zn Zn19 1 0.56049646 0.79923336 0.20076664 1.0 Zn Zn20 1 0.29702990 0.93999292 0.06000708 1.0 Zn Zn21 1 0.20076664 0.56049646 0.79923336 1.0 Zn Zn22 1 0.29702990 0.06000708 0.70297010 1.0 Zn Zn23 1 0.79923336 0.20076664 0.56049646 1.0 Zn Zn24 1 0.93999292 0.06000708 0.29702990 1.0 Zn Zn25 1 0.56049646 0.20076664 0.43950354 1.0 Zn Zn26 1 0.00000000 0.00000000 0.00000000 1.0 Pd Pd27 1 0.50000000 0.50000000 0.50000000 1.0