# generated using pymatgen data_RbRuN2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.94339200 _cell_length_b 11.87818000 _cell_length_c 16.70933700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural RbRuN2 _chemical_formula_sum 'Rb16 Ru16 N32' _cell_volume 1179.62371698 _cell_formula_units_Z 16 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 0.25052700 0.00368500 0.43640500 1.0 Rb Rb1 1 0.75052700 0.49631500 0.56359500 1.0 Rb Rb2 1 0.74947300 0.50368500 0.06359500 1.0 Rb Rb3 1 0.24947300 0.99631500 0.93640500 1.0 Rb Rb4 1 0.74947300 0.99631500 0.56359500 1.0 Rb Rb5 1 0.24947300 0.50368500 0.43640500 1.0 Rb Rb6 1 0.25052700 0.49631500 0.93640500 1.0 Rb Rb7 1 0.75052700 0.00368500 0.06359500 1.0 Rb Rb8 1 0.31487700 0.25532700 0.31298600 1.0 Rb Rb9 1 0.81487700 0.24467300 0.68701400 1.0 Rb Rb10 1 0.68512300 0.75532700 0.18701400 1.0 Rb Rb11 1 0.18512300 0.74467300 0.81298600 1.0 Rb Rb12 1 0.68512300 0.74467300 0.68701400 1.0 Rb Rb13 1 0.18512300 0.75532700 0.31298600 1.0 Rb Rb14 1 0.31487700 0.24467300 0.81298600 1.0 Rb Rb15 1 0.81487700 0.25532700 0.18701400 1.0 Ru Ru16 1 0.74945000 0.00471600 0.31248000 1.0 Ru Ru17 1 0.24945000 0.49528400 0.68752000 1.0 Ru Ru18 1 0.25055000 0.50471600 0.18752000 1.0 Ru Ru19 1 0.75055000 0.99528400 0.81248000 1.0 Ru Ru20 1 0.25055000 0.99528400 0.68752000 1.0 Ru Ru21 1 0.75055000 0.50471600 0.31248000 1.0 Ru Ru22 1 0.74945000 0.49528400 0.81248000 1.0 Ru Ru23 1 0.24945000 0.00471600 0.18752000 1.0 Ru Ru24 1 0.79061500 0.25914400 0.43762400 1.0 Ru Ru25 1 0.29061500 0.24085600 0.56237600 1.0 Ru Ru26 1 0.20938500 0.75914400 0.06237600 1.0 Ru Ru27 1 0.70938500 0.74085600 0.93762400 1.0 Ru Ru28 1 0.20938500 0.74085600 0.56237600 1.0 Ru Ru29 1 0.70938500 0.75914400 0.43762400 1.0 Ru Ru30 1 0.79061500 0.24085600 0.93762400 1.0 Ru Ru31 1 0.29061500 0.25914400 0.06237600 1.0 N N32 1 0.08275700 0.27156300 0.48067500 1.0 N N33 1 0.58275700 0.22843700 0.51932500 1.0 N N34 1 0.91724300 0.77156300 0.01932500 1.0 N N35 1 0.41724300 0.72843700 0.98067500 1.0 N N36 1 0.91724300 0.72843700 0.51932500 1.0 N N37 1 0.41724300 0.77156300 0.48067500 1.0 N N38 1 0.08275700 0.22843700 0.98067500 1.0 N N39 1 0.58275700 0.27156300 0.01932500 1.0 N N40 1 0.70428200 0.39877200 0.39408800 1.0 N N41 1 0.20428200 0.10122800 0.60591200 1.0 N N42 1 0.29571800 0.89877200 0.10591200 1.0 N N43 1 0.79571800 0.60122800 0.89408800 1.0 N N44 1 0.29571800 0.60122800 0.60591200 1.0 N N45 1 0.79571800 0.89877200 0.39408800 1.0 N N46 1 0.70428200 0.10122800 0.89408800 1.0 N N47 1 0.20428200 0.39877200 0.10591200 1.0 N N48 1 0.78047900 0.14859500 0.35775900 1.0 N N49 1 0.28047900 0.35140500 0.64224100 1.0 N N50 1 0.21952100 0.64859500 0.14224100 1.0 N N51 1 0.71952100 0.85140500 0.85775900 1.0 N N52 1 0.21952100 0.85140500 0.64224100 1.0 N N53 1 0.71952100 0.64859500 0.35775900 1.0 N N54 1 0.78047900 0.35140500 0.85775900 1.0 N N55 1 0.28047900 0.14859500 0.14224100 1.0 N N56 1 0.54073200 0.48618000 0.22962900 1.0 N N57 1 0.04073200 0.01382000 0.77037100 1.0 N N58 1 0.45926800 0.98618000 0.27037100 1.0 N N59 1 0.95926800 0.51382000 0.72962900 1.0 N N60 1 0.45926800 0.51382000 0.77037100 1.0 N N61 1 0.95926800 0.98618000 0.22962900 1.0 N N62 1 0.54073200 0.01382000 0.72962900 1.0 N N63 1 0.04073200 0.48618000 0.27037100 1.0