# generated using pymatgen data_Mg3Co2O7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.09144362 _cell_length_b 9.09144362 _cell_length_c 5.18755000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 148.26932065 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg3Co2O7 _chemical_formula_sum 'Mg6 Co4 O14' _cell_volume 225.50365438 _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 Mg Mg0 1 0.22810800 0.22810800 0.32117000 1.0 Mg Mg1 1 0.77189200 0.77189200 0.82117000 1.0 Mg Mg2 1 0.05068700 0.43494700 0.17429100 1.0 Mg Mg3 1 0.94931300 0.56505300 0.67429100 1.0 Mg Mg4 1 0.43494700 0.05068700 0.17429100 1.0 Mg Mg5 1 0.56505300 0.94931300 0.67429100 1.0 Co Co6 1 0.85047200 0.64696400 0.25102200 1.0 Co Co7 1 0.14952800 0.35303600 0.75102200 1.0 Co Co8 1 0.35303600 0.14952800 0.75102200 1.0 Co Co9 1 0.64696400 0.85047200 0.25102200 1.0 O O10 1 0.65848200 0.06365600 0.29269000 1.0 O O11 1 0.34151800 0.93634400 0.79269000 1.0 O O12 1 0.93634400 0.34151800 0.79269000 1.0 O O13 1 0.06365600 0.65848200 0.29269000 1.0 O O14 1 0.42417300 0.68984300 0.95144700 1.0 O O15 1 0.57582700 0.31015700 0.45144700 1.0 O O16 1 0.31015700 0.57582700 0.45144700 1.0 O O17 1 0.68984300 0.42417300 0.95144700 1.0 O O18 1 0.98686000 0.13849300 0.06137500 1.0 O O19 1 0.01314000 0.86150700 0.56137500 1.0 O O20 1 0.61986100 0.61986100 0.19717600 1.0 O O21 1 0.38013900 0.38013900 0.69717600 1.0 O O22 1 0.13849300 0.98686000 0.06137500 1.0 O O23 1 0.86150700 0.01314000 0.56137500 1.0