# generated using pymatgen data_Yb3MnNiO6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.15872625 _cell_length_b 6.15874337 _cell_length_c 6.15871764 _cell_angle_alpha 91.60978640 _cell_angle_beta 91.60981016 _cell_angle_gamma 91.60959004 _symmetry_Int_Tables_number 1 _chemical_formula_structural Yb3MnNiO6 _chemical_formula_sum 'Yb6 Mn2 Ni2 O12' _cell_volume 233.31839121 _cell_formula_units_Z 2 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 Yb Yb0 1 0.24999399 0.61618838 0.88381265 1.0 Yb Yb1 1 0.38380504 0.11619541 0.74999946 1.0 Yb Yb2 1 0.11618885 0.74999716 0.38380668 1.0 Yb Yb3 1 0.75000062 0.38381286 0.11619101 1.0 Yb Yb4 1 0.61619125 0.88380857 0.24999831 1.0 Yb Yb5 1 0.88381059 0.25000532 0.61618753 1.0 Mn Mn6 1 0.49999917 0.49999593 0.49999751 1.0 Mn Mn7 1 0.00000061 0.99999840 0.99999732 1.0 Ni Ni8 1 0.74999219 0.75001970 0.75001381 1.0 Ni Ni9 1 0.25001056 0.24999410 0.25000893 1.0 O O10 1 0.54594530 0.20727538 0.42060711 1.0 O O11 1 0.45404962 0.79272233 0.57938441 1.0 O O12 1 0.79272153 0.57937812 0.45404300 1.0 O O13 1 0.57939029 0.45405052 0.79272548 1.0 O O14 1 0.70727619 0.04594431 0.92061001 1.0 O O15 1 0.04595192 0.92061258 0.70727494 1.0 O O16 1 0.07938795 0.29272422 0.95404770 1.0 O O17 1 0.95405441 0.07938989 0.29272899 1.0 O O18 1 0.29272701 0.95405320 0.07939253 1.0 O O19 1 0.42060843 0.54594619 0.20727040 1.0 O O20 1 0.20727551 0.42061277 0.54594893 1.0 O O21 1 0.92061598 0.70727967 0.04595129 1.0