# generated using pymatgen data_NdTh7H30 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.89937359 _cell_length_b 7.89937328 _cell_length_c 7.89937270 _cell_angle_alpha 109.47242548 _cell_angle_beta 109.47242217 _cell_angle_gamma 109.47242427 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdTh7H30 _chemical_formula_sum 'Nd1 Th7 H30' _cell_volume 379.43435781 _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 Nd Nd0 1 0.91607697 0.91607697 0.91607697 1.0 Th Th1 1 0.49950261 0.99932719 0.08333924 1.0 Th Th2 1 0.99932719 0.08333924 0.49950261 1.0 Th Th3 1 0.08333924 0.49950261 0.99932719 1.0 Th Th4 1 0.99953902 0.58530142 0.50156604 1.0 Th Th5 1 0.58530142 0.50156604 0.99953902 1.0 Th Th6 1 0.50156604 0.99953902 0.58530142 1.0 Th Th7 1 0.41556207 0.41556207 0.41556207 1.0 H H8 1 0.65363865 0.97038918 0.37449074 1.0 H H9 1 0.22008714 0.31619545 0.84520853 1.0 H H10 1 0.18443853 0.40500711 0.53112574 1.0 H H11 1 0.09856281 0.28553192 0.12882274 1.0 H H12 1 0.28553192 0.12882274 0.09856281 1.0 H H13 1 0.12882274 0.09856281 0.28553192 1.0 H H14 1 0.46814477 0.15458704 0.87364165 1.0 H H15 1 0.71957178 0.34623759 0.81516735 1.0 H H16 1 0.62656667 0.37504748 0.25010888 1.0 H H17 1 0.25010888 0.62656667 0.37504748 1.0 H H18 1 0.74541911 0.87317054 0.13008184 1.0 H H19 1 0.13008184 0.74541911 0.87317054 1.0 H H20 1 0.37504748 0.25010888 0.62656667 1.0 H H21 1 0.87317054 0.13008184 0.74541911 1.0 H H22 1 0.77788971 0.58857364 0.62110415 1.0 H H23 1 0.31619545 0.84520853 0.22008714 1.0 H H24 1 0.37449074 0.65363865 0.97038918 1.0 H H25 1 0.97038918 0.37449074 0.65363865 1.0 H H26 1 0.53112574 0.18443853 0.40500711 1.0 H H27 1 0.40500711 0.53112574 0.18443853 1.0 H H28 1 0.84520853 0.22008714 0.31619545 1.0 H H29 1 0.90496235 0.68285698 0.03315640 1.0 H H30 1 0.81516735 0.71957178 0.34623759 1.0 H H31 1 0.15458704 0.87364165 0.46814477 1.0 H H32 1 0.68285698 0.03315640 0.90496235 1.0 H H33 1 0.34623759 0.81516735 0.71957178 1.0 H H34 1 0.87364165 0.46814477 0.15458704 1.0 H H35 1 0.62110415 0.77788971 0.58857364 1.0 H H36 1 0.58857364 0.62110415 0.77788971 1.0 H H37 1 0.03315640 0.90496235 0.68285698 1.0