# generated using pymatgen data_Mg(ZrRe6)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.43422784 _cell_length_b 8.43418483 _cell_length_c 8.43418997 _cell_angle_alpha 109.47109792 _cell_angle_beta 109.47139979 _cell_angle_gamma 109.47127982 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg(ZrRe6)4 _chemical_formula_sum 'Mg1 Zr4 Re24' _cell_volume 461.85889381 _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 Mg Mg0 1 0.00000439 0.00000000 0.00000208 1.0 Zr Zr1 1 0.63312490 0.00000000 0.00001189 1.0 Zr Zr2 1 0.00000742 0.63312236 0.99999684 1.0 Zr Zr3 1 0.99998285 0.00000000 0.63311432 1.0 Zr Zr4 1 0.36688506 0.36687764 0.36687447 1.0 Re Re5 1 0.39570180 0.67586244 0.00002634 1.0 Re Re6 1 0.71983935 0.32413756 0.32416389 1.0 Re Re7 1 0.39570505 0.00000000 0.67584133 1.0 Re Re8 1 0.67585224 0.39569863 0.00000902 1.0 Re Re9 1 0.99998029 0.39568226 0.67583878 1.0 Re Re10 1 0.32417616 0.71985554 0.32413889 1.0 Re Re11 1 0.32414688 0.32416489 0.71985298 1.0 Re Re12 1 0.99998198 0.67583511 0.39568809 1.0 Re Re13 1 0.67584304 0.00000000 0.39569360 1.0 Re Re14 1 0.60429803 0.60431774 0.28015653 1.0 Re Re15 1 0.28015361 0.60430137 0.60431039 1.0 Re Re16 1 0.60432062 0.28014446 0.60428335 1.0 Re Re17 1 0.37614248 0.19307804 0.00001842 1.0 Re Re18 1 0.18306444 0.80692196 0.80694039 1.0 Re Re19 1 0.37616011 0.00000000 0.19308379 1.0 Re Re20 1 0.19307306 0.37615120 0.00000187 1.0 Re Re21 1 0.00000273 0.37613437 0.19306812 1.0 Re Re22 1 0.80693323 0.18306516 0.80691065 1.0 Re Re23 1 0.80691324 0.80693651 0.18307638 1.0 Re Re24 1 0.99997673 0.19306349 0.37613987 1.0 Re Re25 1 0.19307201 0.00000000 0.37612779 1.0 Re Re26 1 0.62386836 0.62386563 0.81693375 1.0 Re Re27 1 0.81692186 0.62384880 0.62385067 1.0 Re Re28 1 0.62386807 0.81693484 0.62384550 1.0