# generated using pymatgen data_Pr3(Al7Cu2)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.11004683 _cell_length_b 7.11004683 _cell_length_c 18.92155625 _cell_angle_alpha 87.46961966 _cell_angle_beta 87.46961966 _cell_angle_gamma 137.32311995 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr3(Al7Cu2)4 _chemical_formula_sum 'Pr3 Al28 Cu8' _cell_volume 643.61085980 _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 Pr Pr0 1 0.32990500 0.32990500 0.83434000 1.0 Pr Pr1 1 0.67009500 0.67009500 0.16566000 1.0 Pr Pr2 1 0.00000000 0.00000000 0.50000000 1.0 Al Al3 1 0.90273600 0.54149900 0.05135300 1.0 Al Al4 1 0.23461400 0.87672800 0.38393600 1.0 Al Al5 1 0.56745900 0.21039800 0.71690400 1.0 Al Al6 1 0.09726400 0.45850100 0.94864700 1.0 Al Al7 1 0.43254100 0.78960200 0.28309600 1.0 Al Al8 1 0.76538600 0.12327200 0.61606400 1.0 Al Al9 1 0.45850100 0.09726400 0.94864700 1.0 Al Al10 1 0.78960200 0.43254100 0.28309600 1.0 Al Al11 1 0.12327200 0.76538600 0.61606400 1.0 Al Al12 1 0.54149900 0.90273600 0.05135300 1.0 Al Al13 1 0.87672800 0.23461400 0.38393600 1.0 Al Al14 1 0.21039800 0.56745900 0.71690400 1.0 Al Al15 1 0.68055700 0.91323100 0.90462700 1.0 Al Al16 1 0.02341000 0.24860300 0.24051800 1.0 Al Al17 1 0.35653100 0.58279900 0.57284800 1.0 Al Al18 1 0.31944300 0.08676900 0.09537300 1.0 Al Al19 1 0.64346900 0.41720100 0.42715200 1.0 Al Al20 1 0.97659000 0.75139700 0.75948200 1.0 Al Al21 1 0.08676900 0.31944300 0.09537300 1.0 Al Al22 1 0.41720100 0.64346900 0.42715200 1.0 Al Al23 1 0.75139700 0.97659000 0.75948200 1.0 Al Al24 1 0.91323100 0.68055700 0.90462700 1.0 Al Al25 1 0.24860300 0.02341000 0.24051800 1.0 Al Al26 1 0.58279900 0.35653100 0.57284800 1.0 Al Al27 1 0.50000000 0.50000000 0.00000000 1.0 Al Al28 1 0.83258200 0.83258200 0.33353800 1.0 Al Al29 1 0.16741800 0.16741800 0.66646200 1.0 Al Al30 1 0.00000000 0.00000000 0.00000000 1.0 Cu Cu31 1 0.33387500 0.33387500 0.33354300 1.0 Cu Cu32 1 0.66612500 0.66612500 0.66645700 1.0 Cu Cu33 1 0.66676000 0.16782200 0.16812000 1.0 Cu Cu34 1 0.00000000 0.50000000 0.50000000 1.0 Cu Cu35 1 0.33324000 0.83217800 0.83188000 1.0 Cu Cu36 1 0.16782200 0.66676000 0.16812000 1.0 Cu Cu37 1 0.50000000 0.00000000 0.50000000 1.0 Cu Cu38 1 0.83217800 0.33324000 0.83188000 1.0