# generated using pymatgen data_Mn2BeO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.63443500 _cell_length_b 5.95877700 _cell_length_c 10.12300200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn2BeO4 _chemical_formula_sum 'Mn8 Be4 O16' _cell_volume 279.55241655 _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 Mn Mn0 1 0.50000000 0.00000000 0.50000000 1.0 Mn Mn1 1 0.50000000 0.50000000 0.50000000 1.0 Mn Mn2 1 0.98529200 0.75000000 0.72512000 1.0 Mn Mn3 1 0.48529200 0.25000000 0.77488000 1.0 Mn Mn4 1 0.00000000 0.00000000 0.00000000 1.0 Mn Mn5 1 0.00000000 0.50000000 0.00000000 1.0 Mn Mn6 1 0.51470800 0.75000000 0.22512000 1.0 Mn Mn7 1 0.01470800 0.25000000 0.27488000 1.0 Be Be8 1 0.92281300 0.25000000 0.58777500 1.0 Be Be9 1 0.42281300 0.75000000 0.91222500 1.0 Be Be10 1 0.57718700 0.25000000 0.08777500 1.0 Be Be11 1 0.07718700 0.75000000 0.41222500 1.0 O O12 1 0.24537600 0.75000000 0.56273700 1.0 O O13 1 0.26798100 0.25000000 0.58658400 1.0 O O14 1 0.75732900 0.02811800 0.65366800 1.0 O O15 1 0.75732900 0.47188200 0.65366800 1.0 O O16 1 0.25732900 0.52811800 0.84633200 1.0 O O17 1 0.25732900 0.97188200 0.84633200 1.0 O O18 1 0.76798100 0.75000000 0.91341600 1.0 O O19 1 0.74537600 0.25000000 0.93726300 1.0 O O20 1 0.25462400 0.75000000 0.06273700 1.0 O O21 1 0.23201900 0.25000000 0.08658400 1.0 O O22 1 0.74267100 0.02811800 0.15366800 1.0 O O23 1 0.74267100 0.47188200 0.15366800 1.0 O O24 1 0.24267100 0.52811800 0.34633200 1.0 O O25 1 0.24267100 0.97188200 0.34633200 1.0 O O26 1 0.73201900 0.75000000 0.41341600 1.0 O O27 1 0.75462400 0.25000000 0.43726300 1.0