# generated using pymatgen data_VCr2Ni3(PO4)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.36521304 _cell_length_b 8.36521304 _cell_length_c 8.36521319 _cell_angle_alpha 62.00391177 _cell_angle_beta 62.00391177 _cell_angle_gamma 62.00391190 _symmetry_Int_Tables_number 1 _chemical_formula_structural VCr2Ni3(PO4)6 _chemical_formula_sum 'V1 Cr2 Ni3 P6 O24' _cell_volume 432.47207588 _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 0.14618900 0.14618900 0.14618900 1.0 Cr Cr1 1 0.99900000 0.99900000 0.99900000 1.0 Cr Cr2 1 0.49771300 0.49771300 0.49771300 1.0 Ni Ni3 1 0.64226900 0.64226900 0.64226900 1.0 Ni Ni4 1 0.85544200 0.85544200 0.85544200 1.0 Ni Ni5 1 0.35755400 0.35755400 0.35755400 1.0 P P6 1 0.95219400 0.25266100 0.55058800 1.0 P P7 1 0.55058800 0.95219400 0.25266100 1.0 P P8 1 0.25266100 0.55058800 0.95219400 1.0 P P9 1 0.74959900 0.45307100 0.04721400 1.0 P P10 1 0.45307100 0.04721400 0.74959900 1.0 P P11 1 0.04721400 0.74959900 0.45307100 1.0 O O12 1 0.50546500 0.10412800 0.32788800 1.0 O O13 1 0.32788800 0.50546500 0.10412800 1.0 O O14 1 0.10412800 0.32788800 0.50546500 1.0 O O15 1 0.93770000 0.09573700 0.74914900 1.0 O O16 1 0.01516000 0.17340500 0.38070700 1.0 O O17 1 0.75191700 0.39921200 0.54884500 1.0 O O18 1 0.74914900 0.93770000 0.09573700 1.0 O O19 1 0.54884500 0.75191700 0.39921200 1.0 O O20 1 0.82785600 0.60196200 0.00877200 1.0 O O21 1 0.39921200 0.54884500 0.75191700 1.0 O O22 1 0.91239700 0.24405500 0.06829700 1.0 O O23 1 0.60196200 0.00877200 0.82785600 1.0 O O24 1 0.38070700 0.01516000 0.17340500 1.0 O O25 1 0.09573700 0.74914900 0.93770000 1.0 O O26 1 0.59989900 0.43291800 0.25206200 1.0 O O27 1 0.17340500 0.38070700 0.01516000 1.0 O O28 1 0.43291800 0.25206200 0.59989900 1.0 O O29 1 0.24405500 0.06829700 0.91239700 1.0 O O30 1 0.25206200 0.59989900 0.43291800 1.0 O O31 1 0.00877200 0.82785600 0.60196200 1.0 O O32 1 0.06829700 0.91239700 0.24405500 1.0 O O33 1 0.89312300 0.68551200 0.48034100 1.0 O O34 1 0.68551200 0.48034100 0.89312300 1.0 O O35 1 0.48034100 0.89312300 0.68551200 1.0