# generated using pymatgen data_NiHgO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.55840053 _cell_length_b 6.42187103 _cell_length_c 7.10933341 _cell_angle_alpha 63.15293235 _cell_angle_beta 105.09111545 _cell_angle_gamma 89.99941826 _symmetry_Int_Tables_number 1 _chemical_formula_structural NiHgO2 _chemical_formula_sum 'Ni4 Hg4 O8' _cell_volume 216.56275852 _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 Ni Ni0 1 0.49999800 0.75047900 0.49999500 1.0 Ni Ni1 1 0.00000000 0.99952500 0.50000300 1.0 Ni Ni2 1 0.50000700 0.25049700 0.50000000 1.0 Ni Ni3 1 0.99999100 0.49950100 0.50000000 1.0 Hg Hg4 1 0.00000200 0.00007400 0.00000100 1.0 Hg Hg5 1 0.50000000 0.24992500 0.00000100 1.0 Hg Hg6 1 0.00000100 0.50007500 0.00000000 1.0 Hg Hg7 1 0.49999900 0.74992500 0.99999900 1.0 O O8 1 0.11105400 0.83307800 0.33342000 1.0 O O9 1 0.61105300 0.08348100 0.33342000 1.0 O O10 1 0.11105600 0.33307900 0.33342100 1.0 O O11 1 0.61105600 0.58348000 0.33341900 1.0 O O12 1 0.88894800 0.66651700 0.66658000 1.0 O O13 1 0.38894700 0.91692200 0.66658000 1.0 O O14 1 0.88894500 0.16652000 0.66658100 1.0 O O15 1 0.38894400 0.41692100 0.66657900 1.0