# generated using pymatgen data_AlGaNiO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.70151617 _cell_length_b 5.79644006 _cell_length_c 8.16539579 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural AlGaNiO4 _chemical_formula_sum 'Al4 Ga4 Ni4 O16' _cell_volume 269.85405620 _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 Al Al0 1 0.00000000 0.50000000 0.50000000 1.0 Al Al1 1 0.50000000 0.00000000 0.00000000 1.0 Al Al2 1 0.00000000 0.00000000 0.50000000 1.0 Al Al3 1 0.50000000 0.50000000 0.00000000 1.0 Ga Ga4 1 0.00000000 0.25000000 0.13310875 1.0 Ga Ga5 1 0.50000000 0.75000000 0.63310875 1.0 Ga Ga6 1 0.00000000 0.75000000 0.86689125 1.0 Ga Ga7 1 0.50000000 0.25000000 0.36689125 1.0 Ni Ni8 1 0.25000000 0.25000000 0.75000000 1.0 Ni Ni9 1 0.75000000 0.25000000 0.75000000 1.0 Ni Ni10 1 0.75000000 0.75000000 0.25000000 1.0 Ni Ni11 1 0.25000000 0.75000000 0.25000000 1.0 O O12 1 0.00000000 0.50544690 0.27006197 1.0 O O13 1 0.50000000 0.00544690 0.77006197 1.0 O O14 1 0.00000000 0.99455310 0.27006197 1.0 O O15 1 0.50000000 0.49455310 0.77006197 1.0 O O16 1 0.00000000 0.00544690 0.72993803 1.0 O O17 1 0.50000000 0.50544690 0.22993803 1.0 O O18 1 0.00000000 0.49455310 0.72993803 1.0 O O19 1 0.50000000 0.99455310 0.22993803 1.0 O O20 1 0.22735454 0.75000000 0.50100879 1.0 O O21 1 0.72735454 0.25000000 0.00100879 1.0 O O22 1 0.77264546 0.75000000 0.50100879 1.0 O O23 1 0.27264546 0.25000000 0.00100879 1.0 O O24 1 0.22735454 0.25000000 0.49899121 1.0 O O25 1 0.72735454 0.75000000 0.99899121 1.0 O O26 1 0.77264546 0.25000000 0.49899121 1.0 O O27 1 0.27264546 0.75000000 0.99899121 1.0