# generated using pymatgen data_Y(NiO2)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 18.31402323 _cell_length_b 6.13422929 _cell_length_c 6.13422838 _cell_angle_alpha 59.99161070 _cell_angle_beta 59.68974196 _cell_angle_gamma 59.68973144 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y(NiO2)3 _chemical_formula_sum 'Y4 Ni12 O24' _cell_volume 484.96316033 _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 Y Y0 1 0.22019800 0.61345100 0.61345100 1.0 Y Y1 1 0.53779100 0.62687400 0.62687400 1.0 Y Y2 1 0.11313500 0.38654900 0.38654900 1.0 Y Y3 1 0.79554200 0.37312600 0.37312600 1.0 Ni Ni4 1 0.99810700 0.50558800 0.00032100 1.0 Ni Ni5 1 0.33522600 0.49441200 0.99967900 1.0 Ni Ni6 1 0.66666700 0.50000000 0.00000000 1.0 Ni Ni7 1 0.99797100 0.00092900 0.00092900 1.0 Ni Ni8 1 0.33536200 0.99907100 0.99907100 1.0 Ni Ni9 1 0.66666700 0.00000000 0.00000000 1.0 Ni Ni10 1 0.16666700 0.00000000 0.00000000 1.0 Ni Ni11 1 0.49927500 0.99871700 0.99871700 1.0 Ni Ni12 1 0.83405800 0.00128300 0.00128300 1.0 Ni Ni13 1 0.99810700 0.00032100 0.50558800 1.0 Ni Ni14 1 0.33522600 0.99967900 0.49441200 1.0 Ni Ni15 1 0.66666700 0.00000000 0.50000000 1.0 O O16 1 0.07555300 0.75574000 0.75574000 1.0 O O17 1 0.40098600 0.76362100 0.76362100 1.0 O O18 1 0.72721300 0.76304100 0.76304100 1.0 O O19 1 0.07140700 0.23422200 0.80868900 1.0 O O20 1 0.41221600 0.21743100 0.81534800 1.0 O O21 1 0.74911400 0.22777300 0.80406000 1.0 O O22 1 0.07140700 0.80868900 0.23422200 1.0 O O23 1 0.41221600 0.81534800 0.21743100 1.0 O O24 1 0.74911400 0.80406000 0.22777300 1.0 O O25 1 0.07198900 0.23721300 0.23721300 1.0 O O26 1 0.41376500 0.22112300 0.22112300 1.0 O O27 1 0.74950200 0.22644100 0.22644100 1.0 O O28 1 0.26192600 0.76577800 0.19131100 1.0 O O29 1 0.58422000 0.77222700 0.19594000 1.0 O O30 1 0.92111700 0.78256900 0.18465200 1.0 O O31 1 0.25778100 0.24426000 0.24426000 1.0 O O32 1 0.60612000 0.23695900 0.23695900 1.0 O O33 1 0.93234700 0.23637900 0.23637900 1.0 O O34 1 0.26192600 0.19131100 0.76577800 1.0 O O35 1 0.58422000 0.19594000 0.77222700 1.0 O O36 1 0.92111700 0.18465200 0.78256900 1.0 O O37 1 0.26134500 0.76278700 0.76278700 1.0 O O38 1 0.58383100 0.77355900 0.77355900 1.0 O O39 1 0.91956800 0.77887700 0.77887700 1.0