# generated using pymatgen data_Yb2TaH9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.57884794 _cell_length_b 8.57884745 _cell_length_c 4.91548511 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000188 _symmetry_Int_Tables_number 1 _chemical_formula_structural Yb2TaH9 _chemical_formula_sum 'Yb6 Ta3 H27' _cell_volume 313.29605301 _cell_formula_units_Z 3 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 Yb Yb0 1 0.00000000 0.26536939 0.50000000 1.0 Yb Yb1 1 0.73463061 0.73463061 0.50000000 1.0 Yb Yb2 1 0.26536939 0.00000000 0.50000000 1.0 Yb Yb3 1 0.00000000 0.60218407 0.00000000 1.0 Yb Yb4 1 0.39781593 0.39781593 0.00000000 1.0 Yb Yb5 1 0.60218407 0.00000000 0.00000000 1.0 Ta Ta6 1 0.66666700 0.33333300 0.50000000 1.0 Ta Ta7 1 0.33333300 0.66666700 0.50000000 1.0 Ta Ta8 1 0.00000000 0.00000000 0.00000000 1.0 H H9 1 0.82227198 0.33803724 0.76657474 1.0 H H10 1 0.66196276 0.48423174 0.76657474 1.0 H H11 1 0.51576826 0.17772802 0.76657474 1.0 H H12 1 0.17772802 0.51576826 0.23342526 1.0 H H13 1 0.51576826 0.17772802 0.23342526 1.0 H H14 1 0.82227198 0.33803724 0.23342526 1.0 H H15 1 0.66196276 0.48423174 0.23342526 1.0 H H16 1 0.33803724 0.82227198 0.76657474 1.0 H H17 1 0.48423174 0.66196276 0.76657474 1.0 H H18 1 0.21358663 0.00000000 0.00000000 1.0 H H19 1 0.78641337 0.78641337 0.00000000 1.0 H H20 1 0.00000000 0.21358663 0.00000000 1.0 H H21 1 0.84514718 0.00000000 0.25917065 1.0 H H22 1 0.15485282 0.15485282 0.74082935 1.0 H H23 1 1.00000000 0.84514718 0.74082935 1.0 H H24 1 1.00000000 0.84514718 0.25917065 1.0 H H25 1 0.15485282 0.15485282 0.25917065 1.0 H H26 1 0.84514718 0.00000000 0.74082935 1.0 H H27 1 0.13282501 0.68550255 0.50000000 1.0 H H28 1 0.55267754 0.86717499 0.50000000 1.0 H H29 1 0.31449745 0.44732246 0.50000000 1.0 H H30 1 0.44732246 0.31449745 0.50000000 1.0 H H31 1 0.86717499 0.55267754 0.50000000 1.0 H H32 1 0.68550255 0.13282501 0.50000000 1.0 H H33 1 0.17772802 0.51576826 0.76657474 1.0 H H34 1 0.33803724 0.82227198 0.23342526 1.0 H H35 1 0.48423174 0.66196276 0.23342526 1.0