# generated using pymatgen data_RbNbH5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.97859570 _cell_length_b 7.28458919 _cell_length_c 5.19789930 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural RbNbH5 _chemical_formula_sum 'Rb4 Nb4 H20' _cell_volume 415.69970693 _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 Rb Rb0 1 0.67053875 0.07221474 0.34484844 1.0 Rb Rb1 1 0.17053875 0.42778426 0.34484844 1.0 Rb Rb2 1 0.82946125 0.57221474 0.84484844 1.0 Rb Rb3 1 0.32946125 0.92778526 0.84484844 1.0 Nb Nb4 1 0.51817977 0.56129677 0.30344975 1.0 Nb Nb5 1 0.01817977 0.93870323 0.30344975 1.0 Nb Nb6 1 0.98182023 0.06129577 0.80344875 1.0 Nb Nb7 1 0.48182023 0.43870423 0.80344875 1.0 H H8 1 0.33468654 0.32490925 0.81491222 1.0 H H9 1 0.83468654 0.17509075 0.81491222 1.0 H H10 1 0.98129582 0.69475277 0.31484726 1.0 H H11 1 0.48129582 0.80524623 0.31484726 1.0 H H12 1 0.60041918 0.39495173 0.06950810 1.0 H H13 1 0.10041818 0.10504827 0.06950810 1.0 H H14 1 0.38171625 0.54826323 0.06443345 1.0 H H15 1 0.88171625 0.95173777 0.06443345 1.0 H H16 1 0.95019056 0.16011645 0.45499978 1.0 H H17 1 0.45019056 0.33988455 0.45499978 1.0 H H18 1 0.16531346 0.82490925 0.31491122 1.0 H H19 1 0.66531346 0.67508975 0.31491122 1.0 H H20 1 0.51870518 0.19475277 0.81484926 1.0 H H21 1 0.01870518 0.30524623 0.81484926 1.0 H H22 1 0.89958182 0.89495073 0.56950810 1.0 H H23 1 0.39958182 0.60504927 0.56950810 1.0 H H24 1 0.11828375 0.04826223 0.56443345 1.0 H H25 1 0.61828375 0.45173777 0.56443345 1.0 H H26 1 0.54980944 0.66011645 0.95500178 1.0 H H27 1 0.04980944 0.83988455 0.95500178 1.0