# generated using pymatgen data_LaPa(Al5Fe)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.73848716 _cell_length_b 6.73833227 _cell_length_c 8.92449595 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 97.86749758 _symmetry_Int_Tables_number 1 _chemical_formula_structural LaPa(Al5Fe)4 _chemical_formula_sum 'La1 Pa1 Al20 Fe4' _cell_volume 401.41284792 _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 La La0 1 0.12359612 0.87650258 0.25000000 1.0 Pa Pa1 1 0.87455380 0.12543636 0.75000000 1.0 Al Al2 1 0.62358677 0.37641262 0.55396339 1.0 Al Al3 1 0.37523758 0.62476084 0.45295520 1.0 Al Al4 1 0.37523758 0.62476084 0.04704480 1.0 Al Al5 1 0.62358677 0.37641262 0.94603661 1.0 Al Al6 1 0.22822669 0.22770276 0.50231908 1.0 Al Al7 1 0.77228924 0.77177774 0.50232028 1.0 Al Al8 1 0.77228924 0.77177774 0.99767972 1.0 Al Al9 1 0.22822669 0.22770276 0.99768092 1.0 Al Al10 1 0.83640344 0.16359455 0.09801600 1.0 Al Al11 1 0.15873654 0.84126423 0.89999767 1.0 Al Al12 1 0.15873654 0.84126423 0.60000233 1.0 Al Al13 1 0.83640344 0.16359455 0.40198400 1.0 Al Al14 1 0.86820636 0.59037397 0.75000000 1.0 Al Al15 1 0.13373642 0.40846954 0.25000000 1.0 Al Al16 1 0.40964013 0.13176084 0.75000000 1.0 Al Al17 1 0.59151692 0.86625345 0.25000000 1.0 Al Al18 1 0.22050299 0.47926825 0.75000000 1.0 Al Al19 1 0.77798748 0.51923721 0.25000000 1.0 Al Al20 1 0.52076177 0.77951000 0.75000000 1.0 Al Al21 1 0.48074987 0.22198384 0.25000000 1.0 Fe Fe22 1 0.99868068 0.49377308 0.50488389 1.0 Fe Fe23 1 0.99868068 0.49377308 0.99511611 1.0 Fe Fe24 1 0.50621563 0.00131367 0.99512117 1.0 Fe Fe25 1 0.50621563 0.00131367 0.50487883 1.0