# generated using pymatgen data_NbFe3Co2(PO4)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.58044580 _cell_length_b 8.58044580 _cell_length_c 8.58044647 _cell_angle_alpha 60.85737038 _cell_angle_beta 60.85737038 _cell_angle_gamma 60.85737138 _symmetry_Int_Tables_number 1 _chemical_formula_structural NbFe3Co2(PO4)6 _chemical_formula_sum 'Nb1 Fe3 Co2 P6 O24' _cell_volume 455.33361034 _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 Nb Nb0 1 0.85778300 0.85778300 0.85778300 1.0 Fe Fe1 1 0.35550400 0.35550400 0.35550400 1.0 Fe Fe2 1 0.14631400 0.14631400 0.14631400 1.0 Fe Fe3 1 0.64407900 0.64407900 0.64407900 1.0 Co Co4 1 0.00707200 0.00707200 0.00707200 1.0 Co Co5 1 0.50035900 0.50035900 0.50035900 1.0 P P6 1 0.44932300 0.74639900 0.04742500 1.0 P P7 1 0.74639900 0.04742500 0.44932300 1.0 P P8 1 0.04742500 0.44932300 0.74639900 1.0 P P9 1 0.95444000 0.53890800 0.25686200 1.0 P P10 1 0.25686200 0.95444000 0.53890800 1.0 P P11 1 0.53890800 0.25686200 0.95444000 1.0 O O12 1 0.68304800 0.88873300 0.49560600 1.0 O O13 1 0.88873300 0.49560600 0.68304800 1.0 O O14 1 0.49560600 0.68304800 0.88873300 1.0 O O15 1 0.25805700 0.91001000 0.06091800 1.0 O O16 1 0.61432800 0.81648900 0.99485100 1.0 O O17 1 0.44430900 0.59126000 0.24164500 1.0 O O18 1 0.91001000 0.06091800 0.25805700 1.0 O O19 1 0.59126000 0.24164500 0.44430900 1.0 O O20 1 0.99580900 0.38784900 0.18409600 1.0 O O21 1 0.24164500 0.44430900 0.59126000 1.0 O O22 1 0.93736200 0.73905700 0.09217400 1.0 O O23 1 0.18409600 0.99580900 0.38784900 1.0 O O24 1 0.81648900 0.99485100 0.61432800 1.0 O O25 1 0.06091800 0.25805700 0.91001000 1.0 O O26 1 0.75779300 0.55793900 0.41123400 1.0 O O27 1 0.99485100 0.61432800 0.81648900 1.0 O O28 1 0.41123400 0.75779300 0.55793900 1.0 O O29 1 0.09217400 0.93736200 0.73905700 1.0 O O30 1 0.55793900 0.41123400 0.75779300 1.0 O O31 1 0.38784900 0.18409600 0.99580900 1.0 O O32 1 0.73905700 0.09217400 0.93736200 1.0 O O33 1 0.50557000 0.31479200 0.11262200 1.0 O O34 1 0.11262200 0.50557000 0.31479200 1.0 O O35 1 0.31479200 0.11262200 0.50557000 1.0