# generated using pymatgen data_MnFe2(PO9)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.32543200 _cell_length_b 7.22015907 _cell_length_c 10.10152247 _cell_angle_alpha 96.54352773 _cell_angle_beta 99.75977914 _cell_angle_gamma 110.21982185 _symmetry_Int_Tables_number 1 _chemical_formula_structural MnFe2(PO9)2 _chemical_formula_sum 'Mn1 Fe2 P2 O18' _cell_volume 352.88951974 _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 Mn Mn0 1 0.50000000 0.50000000 0.50000000 1.0 Fe Fe1 1 0.00000000 0.00000000 0.00000000 1.0 Fe Fe2 1 0.00000000 0.50000000 0.00000000 1.0 P P3 1 0.49117600 0.40681100 0.17751200 1.0 P P4 1 0.50882400 0.59318900 0.82248800 1.0 O O5 1 0.56503100 0.39131200 0.32810400 1.0 O O6 1 0.43496900 0.60868800 0.67189600 1.0 O O7 1 0.75261700 0.50792700 0.12786900 1.0 O O8 1 0.24738300 0.49207300 0.87213100 1.0 O O9 1 0.35989600 0.18371700 0.09257700 1.0 O O10 1 0.64010400 0.81628300 0.90742300 1.0 O O11 1 0.29800200 0.52189400 0.15612800 1.0 O O12 1 0.70199800 0.47810600 0.84387200 1.0 O O13 1 0.00030200 0.93926300 0.17040600 1.0 O O14 1 0.99969800 0.06073700 0.82959400 1.0 O O15 1 0.30671700 0.15169500 0.53943800 1.0 O O16 1 0.69328300 0.84830500 0.46056200 1.0 O O17 1 0.19587300 0.48776400 0.42146500 1.0 O O18 1 0.80412700 0.51223600 0.57853500 1.0 O O19 1 0.62849600 0.89752600 0.35083000 1.0 O O20 1 0.37150400 0.10247400 0.64917000 1.0 O O21 1 0.13412800 0.80101800 0.00849100 1.0 O O22 1 0.86587200 0.19898200 0.99150900 1.0