# generated using pymatgen data_Mg3MnNi3O8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.94826563 _cell_length_b 5.94826563 _cell_length_c 5.94826585 _cell_angle_alpha 60.51667304 _cell_angle_beta 60.51667304 _cell_angle_gamma 60.51667251 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg3MnNi3O8 _chemical_formula_sum 'Mg3 Mn1 Ni3 O8' _cell_volume 150.55573537 _cell_formula_units_Z 1 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 Mg Mg0 1 0.50000000 0.50000000 0.00000000 1.0 Mg Mg1 1 0.00000000 0.50000000 0.50000000 1.0 Mg Mg2 1 0.50000000 0.00000000 0.50000000 1.0 Mn Mn3 1 0.00000000 0.00000000 0.00000000 1.0 Ni Ni4 1 0.00000000 0.00000000 0.50000000 1.0 Ni Ni5 1 0.50000000 0.00000000 0.00000000 1.0 Ni Ni6 1 0.00000000 0.50000000 0.00000000 1.0 O O7 1 0.74889000 0.74889000 0.74889000 1.0 O O8 1 0.25111000 0.25111000 0.25111000 1.0 O O9 1 0.77050700 0.77050700 0.23031800 1.0 O O10 1 0.23031800 0.77050700 0.77050700 1.0 O O11 1 0.77050700 0.23031800 0.77050700 1.0 O O12 1 0.22949300 0.22949300 0.76968200 1.0 O O13 1 0.76968200 0.22949300 0.22949300 1.0 O O14 1 0.22949300 0.76968200 0.22949300 1.0