# generated using pymatgen data_YbThH6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.79439850 _cell_length_b 6.95249736 _cell_length_c 6.79439850 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural YbThH6 _chemical_formula_sum 'Yb4 Th4 H24' _cell_volume 320.95405175 _cell_formula_units_Z 4 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 0.23727633 0.00000000 0.50000000 1.0 Yb Yb1 1 0.76272367 0.00000000 0.50000000 1.0 Yb Yb2 1 0.00000000 0.50000000 0.26272367 1.0 Yb Yb3 1 0.00000000 0.50000000 0.73727633 1.0 Th Th4 1 0.00000000 0.00000000 0.00000000 1.0 Th Th5 1 0.50000000 0.50000000 0.50000000 1.0 Th Th6 1 0.50000000 0.75000000 0.00000000 1.0 Th Th7 1 0.50000000 0.25000000 0.00000000 1.0 H H8 1 0.00000000 0.15420463 0.29673899 1.0 H H9 1 0.50000000 0.20934895 0.66244571 1.0 H H10 1 0.50000000 0.79065105 0.33755429 1.0 H H11 1 0.79673899 0.65420463 0.50000000 1.0 H H12 1 0.20326101 0.65420463 0.50000000 1.0 H H13 1 0.34784124 0.50000000 0.81837691 1.0 H H14 1 0.65215876 0.50000000 0.81837691 1.0 H H15 1 0.31837691 0.00000000 0.15215876 1.0 H H16 1 0.16244571 0.29065105 0.00000000 1.0 H H17 1 0.83755429 0.70934895 0.00000000 1.0 H H18 1 0.31837691 0.00000000 0.84784124 1.0 H H19 1 0.83755429 0.29065105 0.00000000 1.0 H H20 1 0.68162309 0.00000000 0.15215876 1.0 H H21 1 0.68162309 0.00000000 0.84784124 1.0 H H22 1 0.16244571 0.70934895 0.00000000 1.0 H H23 1 0.00000000 0.84579537 0.70326101 1.0 H H24 1 0.00000000 0.15420463 0.70326101 1.0 H H25 1 0.00000000 0.84579537 0.29673899 1.0 H H26 1 0.65215876 0.50000000 0.18162309 1.0 H H27 1 0.34784124 0.50000000 0.18162309 1.0 H H28 1 0.79673899 0.34579537 0.50000000 1.0 H H29 1 0.20326101 0.34579537 0.50000000 1.0 H H30 1 0.50000000 0.79065105 0.66244571 1.0 H H31 1 0.50000000 0.20934895 0.33755429 1.0