# generated using pymatgen data_Hf3Al2Sn _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.68503030 _cell_length_b 8.67833261 _cell_length_c 9.51403038 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3Al2Sn _chemical_formula_sum 'Hf12 Al8 Sn4' _cell_volume 469.38975800 _cell_formula_units_Z 4 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 Hf Hf0 1 0.00000000 0.75000000 0.12571998 1.0 Hf Hf1 1 0.50000000 0.25000000 0.87428002 1.0 Hf Hf2 1 0.00000000 0.25000000 0.87428002 1.0 Hf Hf3 1 0.50000000 0.75000000 0.12571998 1.0 Hf Hf4 1 0.75000000 0.47140339 0.61993686 1.0 Hf Hf5 1 0.25000000 0.52859661 0.38006314 1.0 Hf Hf6 1 0.75000000 0.97140339 0.38006314 1.0 Hf Hf7 1 0.25000000 0.02859661 0.61993686 1.0 Hf Hf8 1 0.75000000 0.37131644 0.19379741 1.0 Hf Hf9 1 0.25000000 0.62868356 0.80620259 1.0 Hf Hf10 1 0.75000000 0.87131644 0.80620259 1.0 Hf Hf11 1 0.25000000 0.12868356 0.19379741 1.0 Al Al12 1 0.00000000 0.75000000 0.56877688 1.0 Al Al13 1 0.50000000 0.25000000 0.43122312 1.0 Al Al14 1 0.00000000 0.25000000 0.43122312 1.0 Al Al15 1 0.50000000 0.75000000 0.56877688 1.0 Al Al16 1 0.75000000 0.13436204 0.64130533 1.0 Al Al17 1 0.25000000 0.86563796 0.35869467 1.0 Al Al18 1 0.75000000 0.63436204 0.35869467 1.0 Al Al19 1 0.25000000 0.36563796 0.64130533 1.0 Sn Sn20 1 0.75000000 0.05254722 0.08126803 1.0 Sn Sn21 1 0.25000000 0.94745278 0.91873197 1.0 Sn Sn22 1 0.75000000 0.55254722 0.91873197 1.0 Sn Sn23 1 0.25000000 0.44745278 0.08126803 1.0