# generated using pymatgen data_Pr3Al12(OsRu)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.86814943 _cell_length_b 8.88883856 _cell_length_c 9.67155128 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.07720329 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr3Al12(OsRu)2 _chemical_formula_sum 'Pr6 Al24 Os4 Ru4' _cell_volume 659.73026172 _cell_formula_units_Z 2 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 0.19416365 0.38447492 0.25000000 1.0 Pr Pr1 1 0.80583635 0.61552508 0.75000000 1.0 Pr Pr2 1 0.61345988 0.80672994 0.25000000 1.0 Pr Pr3 1 0.38654012 0.19327006 0.75000000 1.0 Pr Pr4 1 0.19416365 0.80968772 0.25000000 1.0 Pr Pr5 1 0.80583635 0.19031228 0.75000000 1.0 Al Al6 1 0.33280574 0.66640387 0.00228396 1.0 Al Al7 1 0.66719426 0.33359613 0.99771604 1.0 Al Al8 1 0.66719426 0.33359613 0.50228396 1.0 Al Al9 1 0.33280574 0.66640387 0.49771604 1.0 Al Al10 1 0.16280647 0.32524888 0.57471758 1.0 Al Al11 1 0.83719353 0.67475112 0.42528242 1.0 Al Al12 1 0.67389079 0.83694540 0.57408826 1.0 Al Al13 1 0.83719353 0.67475112 0.07471758 1.0 Al Al14 1 0.32610921 0.16305460 0.42591174 1.0 Al Al15 1 0.16280647 0.32524888 0.92528242 1.0 Al Al16 1 0.16280647 0.83755658 0.57471758 1.0 Al Al17 1 0.32610921 0.16305460 0.07408826 1.0 Al Al18 1 0.83719353 0.16244342 0.42528242 1.0 Al Al19 1 0.67389079 0.83694540 0.92591174 1.0 Al Al20 1 0.83719353 0.16244342 0.07471758 1.0 Al Al21 1 0.16280647 0.83755658 0.92528242 1.0 Al Al22 1 0.56355979 0.12614064 0.25000000 1.0 Al Al23 1 0.43644021 0.87385936 0.75000000 1.0 Al Al24 1 0.87622454 0.43811227 0.25000000 1.0 Al Al25 1 0.12377546 0.56188773 0.75000000 1.0 Al Al26 1 0.56355979 0.43741915 0.25000000 1.0 Al Al27 1 0.43644021 0.56258085 0.75000000 1.0 Al Al28 1 0.99958992 0.99979496 0.25000000 1.0 Al Al29 1 0.00041008 0.00020504 0.75000000 1.0 Os Os30 1 0.50000000 0.00000000 0.00000000 1.0 Os Os31 1 0.50000000 0.00000000 0.50000000 1.0 Os Os32 1 0.50000000 0.50000000 0.00000000 1.0 Os Os33 1 0.50000000 0.50000000 0.50000000 1.0 Ru Ru34 1 0.00000000 0.50000000 0.00000000 1.0 Ru Ru35 1 0.00000000 0.50000000 0.50000000 1.0 Ru Ru36 1 0.00000000 0.00000000 0.00000000 1.0 Ru Ru37 1 0.00000000 0.00000000 0.50000000 1.0