# generated using pymatgen data_Cr2Fe3Sb(PO4)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.58032813 _cell_length_b 8.58032813 _cell_length_c 8.58032817 _cell_angle_alpha 60.66415662 _cell_angle_beta 60.66415662 _cell_angle_gamma 60.66416380 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cr2Fe3Sb(PO4)6 _chemical_formula_sum 'Cr2 Fe3 Sb1 P6 O24' _cell_volume 453.37759816 _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 Cr Cr0 1 0.99582200 0.99582200 0.99582200 1.0 Cr Cr1 1 0.50176200 0.50176200 0.50176200 1.0 Fe Fe2 1 0.85357900 0.85357900 0.85357900 1.0 Fe Fe3 1 0.64372400 0.64372400 0.64372400 1.0 Fe Fe4 1 0.35550000 0.35550000 0.35550000 1.0 Sb Sb5 1 0.14387600 0.14387600 0.14387600 1.0 P P6 1 0.25350800 0.54674500 0.95088800 1.0 P P7 1 0.74563600 0.45997000 0.04924200 1.0 P P8 1 0.45997000 0.04924200 0.74563600 1.0 P P9 1 0.04924200 0.74563600 0.45997000 1.0 P P10 1 0.95088800 0.25350800 0.54674500 1.0 P P11 1 0.54674500 0.95088800 0.25350800 1.0 O O12 1 0.89953300 0.68510400 0.48536800 1.0 O O13 1 0.68510400 0.48536800 0.89953300 1.0 O O14 1 0.94066200 0.08974900 0.73919100 1.0 O O15 1 0.48536800 0.89953300 0.68510400 1.0 O O16 1 0.99037500 0.18279400 0.38896400 1.0 O O17 1 0.75322900 0.40701900 0.55600700 1.0 O O18 1 0.73919100 0.94066200 0.08974900 1.0 O O19 1 0.55600700 0.75322900 0.40701900 1.0 O O20 1 0.81878300 0.60991000 0.00869500 1.0 O O21 1 0.40701900 0.55600700 0.75322900 1.0 O O22 1 0.91142900 0.25434700 0.06862200 1.0 O O23 1 0.60991000 0.00869500 0.81878300 1.0 O O24 1 0.38896400 0.99037500 0.18279400 1.0 O O25 1 0.08974900 0.73919100 0.94066200 1.0 O O26 1 0.59297500 0.43806400 0.25283000 1.0 O O27 1 0.18279400 0.38896400 0.99037500 1.0 O O28 1 0.43806400 0.25283000 0.59297500 1.0 O O29 1 0.25434700 0.06862200 0.91142900 1.0 O O30 1 0.25283000 0.59297500 0.43806400 1.0 O O31 1 0.00869500 0.81878300 0.60991000 1.0 O O32 1 0.49703400 0.10906400 0.31999500 1.0 O O33 1 0.06862200 0.91142900 0.25434700 1.0 O O34 1 0.31999500 0.49703400 0.10906400 1.0 O O35 1 0.10906400 0.31999500 0.49703400 1.0