# generated using pymatgen data_HfBe13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.04352184 _cell_length_b 7.04352266 _cell_length_c 7.04352374 _cell_angle_alpha 60.00058327 _cell_angle_beta 60.00060578 _cell_angle_gamma 60.00059681 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfBe13 _chemical_formula_sum 'Hf2 Be26' _cell_volume 247.09310582 _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 Hf Hf0 1 0.75000100 0.75000000 0.75000000 1.0 Hf Hf1 1 0.24999900 0.25000000 0.25000000 1.0 Be Be2 1 0.93850104 0.29396475 0.70603525 1.0 Be Be3 1 0.70603525 0.06149696 0.93850204 1.0 Be Be4 1 0.00000000 -0.00000000 0.00000000 1.0 Be Be5 1 0.50000000 0.50000000 0.50000000 1.0 Be Be6 1 0.29396475 0.93850304 0.06149796 1.0 Be Be7 1 0.56149796 0.43850304 0.79396475 1.0 Be Be8 1 0.79396475 0.20603525 0.56149796 1.0 Be Be9 1 0.56149896 0.79396475 0.20603525 1.0 Be Be10 1 0.43850104 0.20603525 0.79396475 1.0 Be Be11 1 0.43850304 0.79396475 0.56149796 1.0 Be Be12 1 0.79396475 0.43850104 0.20603525 1.0 Be Be13 1 0.06149796 0.29396475 0.93850304 1.0 Be Be14 1 0.93850304 0.06149796 0.29396475 1.0 Be Be15 1 0.70603525 0.29396475 0.06149796 1.0 Be Be16 1 0.93850204 0.70603525 0.06149696 1.0 Be Be17 1 0.70603525 0.93850104 0.29396475 1.0 Be Be18 1 0.06149696 0.93850204 0.70603525 1.0 Be Be19 1 0.29396475 0.06149896 0.70603525 1.0 Be Be20 1 0.29396475 0.70603525 0.93850204 1.0 Be Be21 1 0.79396475 0.56149796 0.43850304 1.0 Be Be22 1 0.20603525 0.79396475 0.43850204 1.0 Be Be23 1 0.20603525 0.56149896 0.79396475 1.0 Be Be24 1 0.56149696 0.20603525 0.43850204 1.0 Be Be25 1 0.43850204 0.56149696 0.20603525 1.0 Be Be26 1 0.20603525 0.43850204 0.56149696 1.0 Be Be27 1 0.06149896 0.70603525 0.29396475 1.0