# generated using pymatgen data_Hf6BeGaSe _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.59512118 _cell_length_b 7.35488642 _cell_length_c 7.35488674 _cell_angle_alpha 120.00000587 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf6BeGaSe _chemical_formula_sum 'Hf6 Be1 Ga1 Se1' _cell_volume 168.42094472 _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 0.50000000 0.75609793 0.76114166 1.0 Hf Hf1 1 0.50000000 0.00504273 0.24390207 1.0 Hf Hf2 1 0.50000000 0.23885834 0.99495727 1.0 Hf Hf3 1 0.00000000 0.40526837 0.40176381 1.0 Hf Hf4 1 0.00000000 0.99649545 0.59473163 1.0 Hf Hf5 1 0.00000000 0.59823619 0.00350455 1.0 Be Be6 1 0.00000000 0.00000000 0.00000000 1.0 Ga Ga7 1 0.50000000 0.33333300 0.66666700 1.0 Se Se8 1 0.50000000 0.66666700 0.33333300 1.0