# generated using pymatgen data_Sr3Np4PaH24 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.77791439 _cell_length_b 6.88258636 _cell_length_c 6.87474539 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr3Np4PaH24 _chemical_formula_sum 'Sr3 Np4 Pa1 H24' _cell_volume 320.70399273 _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 Sr Sr0 1 0.24667901 0.00000000 0.49860165 1.0 Sr Sr1 1 0.75332099 0.00000000 0.49860165 1.0 Sr Sr2 1 0.00000000 0.50000000 0.24879540 1.0 Np Np3 1 0.00000000 0.00000000 0.99633615 1.0 Np Np4 1 0.00000000 0.50000000 0.75249266 1.0 Np Np5 1 0.50000000 0.75262819 0.99999449 1.0 Np Np6 1 0.50000000 0.24737181 0.99999449 1.0 Pa Pa7 1 0.50000000 0.50000000 0.50423403 1.0 H H8 1 0.00000000 0.14913386 0.27543080 1.0 H H9 1 0.50000000 0.22814920 0.66357523 1.0 H H10 1 0.50000000 0.77195080 0.33922988 1.0 H H11 1 0.78972911 0.64343624 0.51877130 1.0 H H12 1 0.21027089 0.64343624 0.51877130 1.0 H H13 1 0.34947773 0.50000000 0.79712603 1.0 H H14 1 0.65052227 0.50000000 0.79712603 1.0 H H15 1 0.31147350 0.00000000 0.14241361 1.0 H H16 1 0.15851552 0.29023479 0.98311715 1.0 H H17 1 0.84148448 0.70976521 0.98311715 1.0 H H18 1 0.31332002 0.00000000 0.85591754 1.0 H H19 1 0.84148448 0.29023479 0.98311715 1.0 H H20 1 0.68852650 0.00000000 0.14241361 1.0 H H21 1 0.68667998 0.00000000 0.85591754 1.0 H H22 1 0.15851552 0.70976521 0.98311715 1.0 H H23 1 0.00000000 0.83774491 0.71807943 1.0 H H24 1 0.00000000 0.16225509 0.71807943 1.0 H H25 1 0.00000000 0.85086614 0.27543080 1.0 H H26 1 0.64201865 0.50000000 0.20492432 1.0 H H27 1 0.35798135 0.50000000 0.20492432 1.0 H H28 1 0.78972911 0.35656376 0.51877130 1.0 H H29 1 0.21027089 0.35656376 0.51877130 1.0 H H30 1 0.50000000 0.77185080 0.66357523 1.0 H H31 1 0.50000000 0.22804920 0.33922988 1.0