# generated using pymatgen data_Ti3FeSb2(PO4)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.89058467 _cell_length_b 8.89058467 _cell_length_c 8.89058493 _cell_angle_alpha 59.06686414 _cell_angle_beta 59.06686414 _cell_angle_gamma 59.06686843 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti3FeSb2(PO4)6 _chemical_formula_sum 'Ti3 Fe1 Sb2 P6 O24' _cell_volume 486.33532743 _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 0.14571200 0.14571200 0.14571200 1.0 Ti Ti1 1 0.35135700 0.35135700 0.35135700 1.0 Ti Ti2 1 0.64943200 0.64943200 0.64943200 1.0 Fe Fe3 1 0.84880100 0.84880100 0.84880100 1.0 Sb Sb4 1 0.99163900 0.99163900 0.99163900 1.0 Sb Sb5 1 0.49715600 0.49715600 0.49715600 1.0 P P6 1 0.95909100 0.53867100 0.25358700 1.0 P P7 1 0.25358700 0.95909100 0.53867100 1.0 P P8 1 0.53867100 0.25358700 0.95909100 1.0 P P9 1 0.45755900 0.75156700 0.04393500 1.0 P P10 1 0.75156700 0.04393500 0.45755900 1.0 P P11 1 0.04393500 0.45755900 0.75156700 1.0 O O12 1 0.49783700 0.31132900 0.11600400 1.0 O O13 1 0.11600400 0.49783700 0.31132900 1.0 O O14 1 0.26533200 0.91415500 0.06406400 1.0 O O15 1 0.31132900 0.11600400 0.49783700 1.0 O O16 1 0.60930700 0.80088300 0.01990600 1.0 O O17 1 0.43237200 0.58199700 0.23505500 1.0 O O18 1 0.91415500 0.06406400 0.26533200 1.0 O O19 1 0.58199700 0.23505500 0.43237200 1.0 O O20 1 0.99616600 0.38354300 0.19593900 1.0 O O21 1 0.23505500 0.43237200 0.58199700 1.0 O O22 1 0.94291100 0.73120700 0.09011300 1.0 O O23 1 0.19593900 0.99616600 0.38354300 1.0 O O24 1 0.80088300 0.01990600 0.60930700 1.0 O O25 1 0.06406400 0.26533200 0.91415500 1.0 O O26 1 0.76915200 0.55835900 0.41936200 1.0 O O27 1 0.01990600 0.60930700 0.80088300 1.0 O O28 1 0.41936200 0.76915200 0.55835900 1.0 O O29 1 0.09011300 0.94291100 0.73120700 1.0 O O30 1 0.55835900 0.41936200 0.76915200 1.0 O O31 1 0.38354300 0.19593900 0.99616600 1.0 O O32 1 0.69631400 0.88545700 0.49473100 1.0 O O33 1 0.73120700 0.09011300 0.94291100 1.0 O O34 1 0.88545700 0.49473100 0.69631400 1.0 O O35 1 0.49473100 0.69631400 0.88545700 1.0