# generated using pymatgen data_MnPO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.62601986 _cell_length_b 8.62601986 _cell_length_c 8.62602012 _cell_angle_alpha 59.66299305 _cell_angle_beta 59.66299305 _cell_angle_gamma 59.66300148 _symmetry_Int_Tables_number 1 _chemical_formula_structural MnPO4 _chemical_formula_sum 'Mn6 P6 O24' _cell_volume 450.37916760 _cell_formula_units_Z 6 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 0.00000000 0.00000000 0.00000000 1.0 Mn Mn1 1 0.35624800 0.35624800 0.35624800 1.0 Mn Mn2 1 0.85624800 0.85624800 0.85624800 1.0 Mn Mn3 1 0.50000000 0.50000000 0.50000000 1.0 Mn Mn4 1 0.14375200 0.14375200 0.14375200 1.0 Mn Mn5 1 0.64375200 0.64375200 0.64375200 1.0 P P6 1 0.04020100 0.45979900 0.75000000 1.0 P P7 1 0.45979900 0.75000000 0.04020100 1.0 P P8 1 0.75000000 0.04020100 0.45979900 1.0 P P9 1 0.25000000 0.95979900 0.54020100 1.0 P P10 1 0.54020100 0.25000000 0.95979900 1.0 P P11 1 0.95979900 0.54020100 0.25000000 1.0 O O12 1 0.48829500 0.69857800 0.88013300 1.0 O O13 1 0.69857800 0.88013300 0.48829500 1.0 O O14 1 0.88013300 0.48829500 0.69857800 1.0 O O15 1 0.05630500 0.26393700 0.91647400 1.0 O O16 1 0.01170500 0.61986700 0.80142200 1.0 O O17 1 0.23606300 0.44369500 0.58352600 1.0 O O18 1 0.26393700 0.91647400 0.05630500 1.0 O O19 1 0.44369500 0.58352600 0.23606300 1.0 O O20 1 0.19857800 0.98829500 0.38013300 1.0 O O21 1 0.58352600 0.23606300 0.44369500 1.0 O O22 1 0.08352600 0.94369500 0.73606300 1.0 O O23 1 0.38013300 0.19857800 0.98829500 1.0 O O24 1 0.61986700 0.80142200 0.01170500 1.0 O O25 1 0.91647400 0.05630500 0.26393700 1.0 O O26 1 0.41647400 0.76393700 0.55630500 1.0 O O27 1 0.80142200 0.01170500 0.61986700 1.0 O O28 1 0.55630500 0.41647400 0.76393700 1.0 O O29 1 0.73606300 0.08352600 0.94369500 1.0 O O30 1 0.76393700 0.55630500 0.41647400 1.0 O O31 1 0.98829500 0.38013300 0.19857800 1.0 O O32 1 0.94369500 0.73606300 0.08352600 1.0 O O33 1 0.11986700 0.51170500 0.30142200 1.0 O O34 1 0.30142200 0.11986700 0.51170500 1.0 O O35 1 0.51170500 0.30142200 0.11986700 1.0