# generated using pymatgen data_Ti3Cr2Sb(PO4)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.71474331 _cell_length_b 8.71474331 _cell_length_c 8.71474324 _cell_angle_alpha 60.16582036 _cell_angle_beta 60.16582036 _cell_angle_gamma 60.16581596 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti3Cr2Sb(PO4)6 _chemical_formula_sum 'Ti3 Cr2 Sb1 P6 O24' _cell_volume 469.76079561 _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 0.14540000 0.14540000 0.14540000 1.0 Ti Ti1 1 0.35316300 0.35316300 0.35316300 1.0 Ti Ti2 1 0.64574300 0.64574300 0.64574300 1.0 Cr Cr3 1 0.00051700 0.00051700 0.00051700 1.0 Cr Cr4 1 0.49836300 0.49836300 0.49836300 1.0 Sb Sb5 1 0.85218100 0.85218100 0.85218100 1.0 P P6 1 0.44205300 0.75046500 0.05069600 1.0 P P7 1 0.75046500 0.05069600 0.44205300 1.0 P P8 1 0.95679500 0.53618400 0.26146200 1.0 P P9 1 0.26146200 0.95679500 0.53618400 1.0 P P10 1 0.53618400 0.26146200 0.95679500 1.0 P P11 1 0.05069600 0.44205300 0.75046500 1.0 O O12 1 0.47608300 0.33770300 0.11066900 1.0 O O13 1 0.11066900 0.47608300 0.33770300 1.0 O O14 1 0.25283200 0.91457000 0.06128900 1.0 O O15 1 0.33770300 0.11066900 0.47608300 1.0 O O16 1 0.58978000 0.80448500 0.03825400 1.0 O O17 1 0.41406100 0.58780900 0.24023000 1.0 O O18 1 0.91457000 0.06128900 0.25283200 1.0 O O19 1 0.58780900 0.24023000 0.41406100 1.0 O O20 1 0.99818700 0.38370500 0.19119900 1.0 O O21 1 0.24023000 0.41406100 0.58780900 1.0 O O22 1 0.95463200 0.72835700 0.10665900 1.0 O O23 1 0.19119900 0.99818700 0.38370500 1.0 O O24 1 0.80448500 0.03825400 0.58978000 1.0 O O25 1 0.06128900 0.25283200 0.91457000 1.0 O O26 1 0.76424200 0.55337100 0.42074000 1.0 O O27 1 0.03825400 0.58978000 0.80448500 1.0 O O28 1 0.42074000 0.76424200 0.55337100 1.0 O O29 1 0.10665900 0.95463200 0.72835700 1.0 O O30 1 0.55337100 0.42074000 0.76424200 1.0 O O31 1 0.38370500 0.19119900 0.99818700 1.0 O O32 1 0.69983900 0.87858100 0.49970400 1.0 O O33 1 0.72835700 0.10665900 0.95463200 1.0 O O34 1 0.87858100 0.49970400 0.69983900 1.0 O O35 1 0.49970400 0.69983900 0.87858100 1.0