# generated using pymatgen data_Mn2P12W _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.47590210 _cell_length_b 8.47590210 _cell_length_c 10.54680617 _cell_angle_alpha 65.66323906 _cell_angle_beta 65.66323906 _cell_angle_gamma 39.36276377 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn2P12W _chemical_formula_sum 'Mn4 P24 W2' _cell_volume 432.08000864 _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 Mn Mn0 1 0.01044481 0.62857188 0.04595403 1.0 Mn Mn1 1 0.37142812 0.98955519 0.45404597 1.0 Mn Mn2 1 0.98955519 0.37142812 0.95404597 1.0 Mn Mn3 1 0.62857188 0.01044481 0.54595403 1.0 P P4 1 0.02195957 0.67173487 0.24144468 1.0 P P5 1 0.32826513 0.97804043 0.25855532 1.0 P P6 1 0.97804043 0.32826513 0.75855532 1.0 P P7 1 0.67173487 0.02195957 0.74144468 1.0 P P8 1 0.98846451 0.07779068 0.07369470 1.0 P P9 1 0.92220932 0.01153549 0.42630530 1.0 P P10 1 0.01153549 0.92220932 0.92630530 1.0 P P11 1 0.07779068 0.98846451 0.57369470 1.0 P P12 1 0.66917711 0.56380493 0.49596622 1.0 P P13 1 0.43619507 0.33082289 0.00403378 1.0 P P14 1 0.33082289 0.43619507 0.50403378 1.0 P P15 1 0.56380493 0.66917711 0.99596622 1.0 P P16 1 0.00247272 0.35382768 0.16345860 1.0 P P17 1 0.64617232 0.99752728 0.33654140 1.0 P P18 1 0.99752728 0.64617232 0.83654140 1.0 P P19 1 0.35382768 0.00247272 0.66345860 1.0 P P20 1 0.70288115 0.42083731 0.33311268 1.0 P P21 1 0.57916269 0.29711885 0.16688732 1.0 P P22 1 0.29711885 0.57916269 0.66688732 1.0 P P23 1 0.42083731 0.70288115 0.83311268 1.0 P P24 1 0.05019669 0.40416344 0.42494913 1.0 P P25 1 0.59583656 0.94980331 0.07505087 1.0 P P26 1 0.94980331 0.59583656 0.57505087 1.0 P P27 1 0.40416344 0.05019669 0.92494913 1.0 W W28 1 0.30464463 0.69535537 0.25000000 1.0 W W29 1 0.69535537 0.30464463 0.75000000 1.0