# generated using pymatgen data_Zr5Be2Nb5Sn6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.43479980 _cell_length_b 8.43479997 _cell_length_c 5.65732040 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.27370550 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr5Be2Nb5Sn6 _chemical_formula_sum 'Zr5 Be2 Nb5 Sn6' _cell_volume 347.60543115 _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 Zr Zr0 1 0.26242700 0.00346626 0.75000000 1.0 Zr Zr1 1 0.00346626 0.26242700 0.75000000 1.0 Zr Zr2 1 0.24384199 0.24384199 0.25000000 1.0 Zr Zr3 1 0.75141873 0.99968183 0.25000000 1.0 Zr Zr4 1 0.99968183 0.75141873 0.25000000 1.0 Be Be5 1 0.99305705 0.99305705 0.97528180 1.0 Be Be6 1 0.99305705 0.99305705 0.52471820 1.0 Nb Nb7 1 0.66685332 0.33370730 0.99871075 1.0 Nb Nb8 1 0.33370730 0.66685332 0.99871075 1.0 Nb Nb9 1 0.33370730 0.66685332 0.50128925 1.0 Nb Nb10 1 0.66685332 0.33370730 0.50128925 1.0 Nb Nb11 1 0.74471190 0.74471190 0.75000000 1.0 Sn Sn12 1 0.39747902 0.39747902 0.75000000 1.0 Sn Sn13 1 0.61184034 0.99851635 0.75000000 1.0 Sn Sn14 1 0.99851635 0.61184034 0.75000000 1.0 Sn Sn15 1 0.60260270 0.60260270 0.25000000 1.0 Sn Sn16 1 0.39682908 0.99994849 0.25000000 1.0 Sn Sn17 1 0.99994849 0.39682908 0.25000000 1.0