# generated using pymatgen data_Hf6Be15Cu8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.79495329 _cell_length_b 7.79495291 _cell_length_c 7.79495085 _cell_angle_alpha 60.00253010 _cell_angle_beta 60.00252680 _cell_angle_gamma 60.00253349 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf6Be15Cu8 _chemical_formula_sum 'Hf6 Be15 Cu8' _cell_volume 334.92711498 _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 Hf Hf0 1 0.70330064 0.29669903 0.29669872 1.0 Hf Hf1 1 0.29669910 0.70330167 0.70330156 1.0 Hf Hf2 1 0.29669838 0.70330131 0.29669820 1.0 Hf Hf3 1 0.70330098 0.29669998 0.70330087 1.0 Hf Hf4 1 0.29669861 0.29669877 0.70330075 1.0 Hf Hf5 1 0.70330155 0.70330124 0.29669928 1.0 Be Be6 1 0.32426200 0.32426157 0.32426154 1.0 Be Be7 1 0.67573863 0.67573826 0.67573832 1.0 Be Be8 1 0.32426141 0.32426092 0.02721819 1.0 Be Be9 1 0.32426129 0.02721815 0.32426095 1.0 Be Be10 1 0.67573976 0.67573884 0.97278193 1.0 Be Be11 1 0.67573955 0.97278200 0.67573903 1.0 Be Be12 1 0.02721828 0.32426085 0.32426133 1.0 Be Be13 1 0.97278211 0.67573927 0.67573927 1.0 Be Be14 1 0.50000044 0.00000003 -0.00000006 1.0 Be Be15 1 0.00000017 0.50000021 0.49999991 1.0 Be Be16 1 0.00000022 0.50000005 0.00000002 1.0 Be Be17 1 0.50000030 0.00000004 0.49999979 1.0 Be Be18 1 0.00000017 0.00000000 0.50000010 1.0 Be Be19 1 0.50000027 0.49999991 0.00000012 1.0 Be Be20 1 0.00000022 0.00000006 0.00000022 1.0 Cu Cu21 1 0.12267301 0.12267360 0.12267376 1.0 Cu Cu22 1 0.87732704 0.87732750 0.87732673 1.0 Cu Cu23 1 0.12267634 0.12267679 0.63197086 1.0 Cu Cu24 1 0.12267636 0.63197095 0.12267691 1.0 Cu Cu25 1 0.87732267 0.87732302 0.36802985 1.0 Cu Cu26 1 0.87732320 0.36802878 0.87732292 1.0 Cu Cu27 1 0.63197225 0.12267626 0.12267645 1.0 Cu Cu28 1 0.36803004 0.87732293 0.87732248 1.0