# generated using pymatgen data_Ti3Cr2Co(PO4)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.64684145 _cell_length_b 8.64684145 _cell_length_c 8.64684170 _cell_angle_alpha 59.93554135 _cell_angle_beta 59.93554135 _cell_angle_gamma 59.93554490 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti3Cr2Co(PO4)6 _chemical_formula_sum 'Ti3 Cr2 Co1 P6 O24' _cell_volume 456.48036100 _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 Ti Ti0 1 0.14433900 0.14433900 0.14433900 1.0 Ti Ti1 1 0.35487100 0.35487100 0.35487100 1.0 Ti Ti2 1 0.64595400 0.64595400 0.64595400 1.0 Cr Cr3 1 0.99714500 0.99714500 0.99714500 1.0 Cr Cr4 1 0.49945200 0.49945200 0.49945200 1.0 Co Co5 1 0.85511800 0.85511800 0.85511800 1.0 P P6 1 0.45789700 0.75159200 0.04331600 1.0 P P7 1 0.75159200 0.04331600 0.45789700 1.0 P P8 1 0.95727500 0.54346700 0.25026100 1.0 P P9 1 0.25026100 0.95727500 0.54346700 1.0 P P10 1 0.54346700 0.25026100 0.95727500 1.0 P P11 1 0.04331600 0.45789700 0.75159200 1.0 O O12 1 0.49373400 0.31287800 0.12016300 1.0 O O13 1 0.12016300 0.49373400 0.31287800 1.0 O O14 1 0.26072900 0.91498500 0.05801800 1.0 O O15 1 0.31287800 0.12016300 0.49373400 1.0 O O16 1 0.61274300 0.80659800 0.01282500 1.0 O O17 1 0.43428200 0.58378800 0.23500300 1.0 O O18 1 0.91498500 0.05801800 0.26072900 1.0 O O19 1 0.58378800 0.23500300 0.43428200 1.0 O O20 1 0.00023500 0.37764800 0.19421000 1.0 O O21 1 0.23500300 0.43428200 0.58378800 1.0 O O22 1 0.94685600 0.73435100 0.08908900 1.0 O O23 1 0.19421000 0.00023500 0.37764800 1.0 O O24 1 0.80659800 0.01282500 0.61274300 1.0 O O25 1 0.05801800 0.26072900 0.91498500 1.0 O O26 1 0.76623500 0.55466300 0.41817700 1.0 O O27 1 0.01282500 0.61274300 0.80659800 1.0 O O28 1 0.41817700 0.76623500 0.55466300 1.0 O O29 1 0.08908900 0.94685600 0.73435100 1.0 O O30 1 0.55466300 0.41817700 0.76623500 1.0 O O31 1 0.37764800 0.19421000 0.00023500 1.0 O O32 1 0.69477300 0.87758300 0.49974900 1.0 O O33 1 0.73435100 0.08908900 0.94685600 1.0 O O34 1 0.87758300 0.49974900 0.69477300 1.0 O O35 1 0.49974900 0.69477300 0.87758300 1.0