# generated using pymatgen data_Ba4B4Pd5Pt11 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.16808564 _cell_length_b 5.65235927 _cell_length_c 12.05410603 _cell_angle_alpha 90.00000000 _cell_angle_beta 89.72735253 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba4B4Pd5Pt11 _chemical_formula_sum 'Ba4 B4 Pd5 Pt11' _cell_volume 420.25243991 _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 0.18366828 0.25000000 0.33303767 1.0 Ba Ba1 1 0.68266806 0.25000000 0.16535837 1.0 Ba Ba2 1 0.81997169 0.75000000 0.66590329 1.0 Ba Ba3 1 0.31845219 0.75000000 0.83403756 1.0 B B4 1 0.09255352 0.25000000 0.94999057 1.0 B B5 1 0.59530358 0.25000000 0.54948900 1.0 B B6 1 0.90374376 0.75000000 0.05028935 1.0 B B7 1 0.40956000 0.75000000 0.45468222 1.0 Pd Pd8 1 0.39291374 0.75000000 0.26632982 1.0 Pd Pd9 1 0.43489845 0.25000000 0.94126189 1.0 Pd Pd10 1 0.93682199 0.25000000 0.55810327 1.0 Pd Pd11 1 0.56074881 0.75000000 0.05784085 1.0 Pd Pd12 1 0.06797095 0.75000000 0.44106306 1.0 Pt Pt13 1 0.10385588 0.25000000 0.76596850 1.0 Pt Pt14 1 0.60675106 0.25000000 0.73378295 1.0 Pt Pt15 1 0.89463844 0.75000000 0.23437770 1.0 Pt Pt16 1 0.33179719 0.00649023 0.58405084 1.0 Pt Pt17 1 0.82937934 0.49470692 0.91639024 1.0 Pt Pt18 1 0.66966929 0.50702137 0.41655317 1.0 Pt Pt19 1 0.16689448 0.99458093 0.08224921 1.0 Pt Pt20 1 0.66966929 0.99297863 0.41655317 1.0 Pt Pt21 1 0.16689448 0.50541907 0.08224921 1.0 Pt Pt22 1 0.33179719 0.49350977 0.58405084 1.0 Pt Pt23 1 0.82937934 0.00529308 0.91639024 1.0