# generated using pymatgen data_TiV3Cr2(PO4)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.60317190 _cell_length_b 8.60317190 _cell_length_c 8.60317162 _cell_angle_alpha 60.19331887 _cell_angle_beta 60.19331887 _cell_angle_gamma 60.19331710 _symmetry_Int_Tables_number 1 _chemical_formula_structural TiV3Cr2(PO4)6 _chemical_formula_sum 'Ti1 V3 Cr2 P6 O24' _cell_volume 452.22839053 _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 0.14568500 0.14568500 0.14568500 1.0 V V1 1 0.64300800 0.64300800 0.64300800 1.0 V V2 1 0.85604700 0.85604700 0.85604700 1.0 V V3 1 0.35713100 0.35713100 0.35713100 1.0 Cr Cr4 1 0.00011700 0.00011700 0.00011700 1.0 Cr Cr5 1 0.49965500 0.49965500 0.49965500 1.0 P P6 1 0.95652600 0.25033900 0.54465900 1.0 P P7 1 0.54465900 0.95652600 0.25033900 1.0 P P8 1 0.25033900 0.54465900 0.95652600 1.0 P P9 1 0.74999700 0.45669300 0.04300300 1.0 P P10 1 0.45669300 0.04300300 0.74999700 1.0 P P11 1 0.04300300 0.74999700 0.45669300 1.0 O O12 1 0.50696700 0.11297700 0.31120000 1.0 O O13 1 0.31120000 0.50696700 0.11297700 1.0 O O14 1 0.11297700 0.31120000 0.50696700 1.0 O O15 1 0.93850200 0.08738200 0.74028700 1.0 O O16 1 0.00414500 0.18558500 0.38182100 1.0 O O17 1 0.76023900 0.41186800 0.55347700 1.0 O O18 1 0.74028700 0.93850200 0.08738200 1.0 O O19 1 0.55347700 0.76023900 0.41186800 1.0 O O20 1 0.81137300 0.61365400 0.00627600 1.0 O O21 1 0.41186800 0.55347700 0.76023900 1.0 O O22 1 0.91508900 0.25890100 0.06077900 1.0 O O23 1 0.61365400 0.00627600 0.81137300 1.0 O O24 1 0.38182100 0.00414500 0.18558500 1.0 O O25 1 0.08738200 0.74028700 0.93850200 1.0 O O26 1 0.58937800 0.43806200 0.24169100 1.0 O O27 1 0.18558500 0.38182100 0.00414500 1.0 O O28 1 0.43806200 0.24169100 0.58937800 1.0 O O29 1 0.25890100 0.06077900 0.91508900 1.0 O O30 1 0.24169100 0.58937800 0.43806200 1.0 O O31 1 0.00627600 0.81137300 0.61365400 1.0 O O32 1 0.06077900 0.91508900 0.25890100 1.0 O O33 1 0.88685000 0.68931100 0.49133700 1.0 O O34 1 0.68931100 0.49133700 0.88685000 1.0 O O35 1 0.49133700 0.88685000 0.68931100 1.0