# generated using pymatgen data_RbNd2I5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.78844500 _cell_length_b 9.88391400 _cell_length_c 14.35507359 _cell_angle_alpha 89.49863116 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural RbNd2I5 _chemical_formula_sum 'Rb4 Nd8 I20' _cell_volume 1246.89473993 _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 0.06104800 0.49608700 0.83139100 1.0 Rb Rb1 1 0.56104800 0.50391300 0.66860900 1.0 Rb Rb2 1 0.93895200 0.50391300 0.16860900 1.0 Rb Rb3 1 0.43895200 0.49608700 0.33139100 1.0 Nd Nd4 1 0.06255800 0.99428700 0.82550800 1.0 Nd Nd5 1 0.93744200 0.00571300 0.17449200 1.0 Nd Nd6 1 0.41403500 0.76979500 0.99703600 1.0 Nd Nd7 1 0.56255800 0.00571300 0.67449200 1.0 Nd Nd8 1 0.58596500 0.23020500 0.00296400 1.0 Nd Nd9 1 0.43744200 0.99428700 0.32550800 1.0 Nd Nd10 1 0.08596500 0.76979500 0.49703600 1.0 Nd Nd11 1 0.91403500 0.23020500 0.50296400 1.0 I I12 1 0.35328200 0.21115500 0.81933900 1.0 I I13 1 0.66767200 0.95496700 0.89485400 1.0 I I14 1 0.82372200 0.22789400 0.72095500 1.0 I I15 1 0.03991800 0.78836300 0.00407800 1.0 I I16 1 0.96008200 0.21163700 0.99592200 1.0 I I17 1 0.17012200 0.46628500 0.57858900 1.0 I I18 1 0.82987800 0.53371500 0.42141100 1.0 I I19 1 0.14671800 0.21115500 0.31933900 1.0 I I20 1 0.17627800 0.77210600 0.27904500 1.0 I I21 1 0.67012200 0.53371500 0.92141100 1.0 I I22 1 0.64671800 0.78884500 0.18066100 1.0 I I23 1 0.32987800 0.46628500 0.07858900 1.0 I I24 1 0.33232800 0.04503300 0.10514600 1.0 I I25 1 0.32372200 0.77210600 0.77904500 1.0 I I26 1 0.85328200 0.78884500 0.68066100 1.0 I I27 1 0.67627800 0.22789400 0.22095500 1.0 I I28 1 0.46008200 0.78836300 0.50407800 1.0 I I29 1 0.53991800 0.21163700 0.49592200 1.0 I I30 1 0.16767200 0.04503300 0.60514600 1.0 I I31 1 0.83232800 0.95496700 0.39485400 1.0