# generated using pymatgen data_V2CrFe3(PO4)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.43583714 _cell_length_b 8.43583714 _cell_length_c 8.43583697 _cell_angle_alpha 61.66652134 _cell_angle_beta 61.66652134 _cell_angle_gamma 61.66652324 _symmetry_Int_Tables_number 1 _chemical_formula_structural V2CrFe3(PO4)6 _chemical_formula_sum 'V2 Cr1 Fe3 P6 O24' _cell_volume 440.35330092 _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 V V0 1 0.99868000 0.99868000 0.99868000 1.0 V V1 1 0.50040800 0.50040800 0.50040800 1.0 Cr Cr2 1 0.14224300 0.14224300 0.14224300 1.0 Fe Fe3 1 0.64694300 0.64694300 0.64694300 1.0 Fe Fe4 1 0.85405900 0.85406000 0.85405900 1.0 Fe Fe5 1 0.35310900 0.35310900 0.35310900 1.0 P P6 1 0.95319200 0.25046200 0.54412700 1.0 P P7 1 0.54412700 0.95319200 0.25046200 1.0 P P8 1 0.25046200 0.54412600 0.95319200 1.0 P P9 1 0.75021100 0.45317500 0.04908700 1.0 P P10 1 0.45317500 0.04908700 0.75021100 1.0 P P11 1 0.04908700 0.75021100 0.45317500 1.0 O O12 1 0.50523100 0.10654400 0.32379700 1.0 O O13 1 0.32379700 0.50523100 0.10654400 1.0 O O14 1 0.10654400 0.32379700 0.50523100 1.0 O O15 1 0.93822700 0.09571600 0.74784200 1.0 O O16 1 0.99364400 0.17980000 0.39020200 1.0 O O17 1 0.75055400 0.40559200 0.56044200 1.0 O O18 1 0.74784200 0.93822700 0.09571600 1.0 O O19 1 0.56044200 0.75055400 0.40559200 1.0 O O20 1 0.82239000 0.60793100 0.00666900 1.0 O O21 1 0.40559200 0.56044200 0.75055400 1.0 O O22 1 0.90603600 0.25027600 0.06324500 1.0 O O23 1 0.60793100 0.00666900 0.82239000 1.0 O O24 1 0.39020200 0.99364400 0.17980000 1.0 O O25 1 0.09571600 0.74784200 0.93822700 1.0 O O26 1 0.59554600 0.43830200 0.25055100 1.0 O O27 1 0.17980000 0.39020200 0.99364400 1.0 O O28 1 0.43830200 0.25055100 0.59554600 1.0 O O29 1 0.25027600 0.06324500 0.90603600 1.0 O O30 1 0.25055100 0.59554600 0.43830200 1.0 O O31 1 0.00666900 0.82239000 0.60793100 1.0 O O32 1 0.06324500 0.90603600 0.25027600 1.0 O O33 1 0.89354500 0.67964000 0.49259600 1.0 O O34 1 0.67964000 0.49259600 0.89354500 1.0 O O35 1 0.49259600 0.89354500 0.67964000 1.0