# generated using pymatgen data_Re2NiO6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 14.46535509 _cell_length_b 11.26398460 _cell_length_c 5.55625800 _cell_angle_alpha 75.43528884 _cell_angle_beta 88.36091194 _cell_angle_gamma 29.53212933 _symmetry_Int_Tables_number 1 _chemical_formula_structural Re2NiO6 _chemical_formula_sum 'Re8 Ni4 O24' _cell_volume 396.09493606 _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 Re Re0 1 0.18402300 0.22488300 0.77486400 1.0 Re Re1 1 0.14932600 0.77508600 0.22523100 1.0 Re Re2 1 0.51032700 0.23096500 0.77672600 1.0 Re Re3 1 0.66010200 0.26185500 0.26313300 1.0 Re Re4 1 0.47279100 0.78741000 0.21908200 1.0 Re Re5 1 0.86044700 0.21268100 0.78085800 1.0 Re Re6 1 0.67318500 0.73824400 0.73668100 1.0 Re Re7 1 0.82314800 0.76893300 0.22315000 1.0 Ni Ni8 1 0.32533700 0.26788800 0.25850400 1.0 Ni Ni9 1 0.00805300 0.73203500 0.74153100 1.0 Ni Ni10 1 0.33588800 0.74114300 0.73099600 1.0 Ni Ni11 1 0.99713500 0.25905600 0.26914600 1.0 O O12 1 0.03008700 0.09849100 0.62079700 1.0 O O13 1 0.32133700 0.12136200 0.11437700 1.0 O O14 1 0.99969500 0.59092800 0.59039400 1.0 O O15 1 0.37904000 0.07662400 0.63542300 1.0 O O16 1 0.01757800 0.61903000 0.09876700 1.0 O O17 1 0.31594800 0.38073100 0.90120000 1.0 O O18 1 0.33376300 0.40895000 0.40959000 1.0 O O19 1 0.01198200 0.87863300 0.88584000 1.0 O O20 1 0.65994800 0.11675700 0.11814400 1.0 O O21 1 0.33178500 0.59085800 0.59457700 1.0 O O22 1 0.36195500 0.60741900 0.10728900 1.0 O O23 1 0.68966400 0.11347000 0.60494800 1.0 O O24 1 0.30324000 0.90157000 0.37933600 1.0 O O25 1 0.66189000 0.36409700 0.92120700 1.0 O O26 1 0.66619400 0.40451200 0.40678100 1.0 O O27 1 0.33737100 0.88825600 0.88274800 1.0 O O28 1 0.99591000 0.11172200 0.11749400 1.0 O O29 1 0.66715500 0.59552800 0.59310900 1.0 O O30 1 0.67152700 0.63580200 0.07891800 1.0 O O31 1 0.97111600 0.39288000 0.89243900 1.0 O O32 1 0.64351200 0.88682400 0.39474300 1.0 O O33 1 0.00161300 0.40907200 0.40537500 1.0 O O34 1 0.67337900 0.88339800 0.88143300 1.0 O O35 1 0.95455100 0.92290500 0.36517000 1.0