# generated using pymatgen data_CrNi(PO4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.38724007 _cell_length_b 8.38724007 _cell_length_c 8.38724006 _cell_angle_alpha 61.99454044 _cell_angle_beta 61.99454044 _cell_angle_gamma 61.99453326 _symmetry_Int_Tables_number 1 _chemical_formula_structural CrNi(PO4)2 _chemical_formula_sum 'Cr3 Ni3 P6 O24' _cell_volume 435.81118243 _cell_formula_units_Z 3 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 Cr Cr0 1 0.99848000 0.99848000 0.99848000 1.0 Cr Cr1 1 0.14230100 0.14230100 0.14230100 1.0 Cr Cr2 1 0.49921600 0.49921600 0.49921600 1.0 Ni Ni3 1 0.64172100 0.64172100 0.64172100 1.0 Ni Ni4 1 0.85685800 0.85685800 0.85685800 1.0 Ni Ni5 1 0.35789800 0.35789800 0.35789800 1.0 P P6 1 0.54671600 0.95344600 0.25121400 1.0 P P7 1 0.25121400 0.54671600 0.95344600 1.0 P P8 1 0.95344600 0.25121400 0.54671600 1.0 P P9 1 0.04797300 0.75030800 0.45210100 1.0 P P10 1 0.75030800 0.45210100 0.04797300 1.0 P P11 1 0.45210100 0.04797300 0.75030800 1.0 O O12 1 0.32902600 0.50776900 0.10327000 1.0 O O13 1 0.10327000 0.32902600 0.50776900 1.0 O O14 1 0.50776900 0.10327000 0.32902600 1.0 O O15 1 0.74953700 0.93826600 0.09761300 1.0 O O16 1 0.38830000 0.00340200 0.17369300 1.0 O O17 1 0.55352100 0.75045300 0.40083800 1.0 O O18 1 0.09761300 0.74953700 0.93826600 1.0 O O19 1 0.40083800 0.55352100 0.75045300 1.0 O O20 1 0.00716800 0.82970700 0.60166200 1.0 O O21 1 0.75045300 0.40083800 0.55352100 1.0 O O22 1 0.06709100 0.90752500 0.24458300 1.0 O O23 1 0.82970700 0.60166200 0.00716800 1.0 O O24 1 0.17369300 0.38830000 0.00340200 1.0 O O25 1 0.93826600 0.09761300 0.74953700 1.0 O O26 1 0.25238400 0.59998800 0.43607700 1.0 O O27 1 0.00340200 0.17369300 0.38830000 1.0 O O28 1 0.59998800 0.43607700 0.25238400 1.0 O O29 1 0.90752500 0.24458300 0.06709100 1.0 O O30 1 0.43607700 0.25238400 0.59998800 1.0 O O31 1 0.60166200 0.00716800 0.82970700 1.0 O O32 1 0.24458300 0.06709100 0.90752500 1.0 O O33 1 0.48436100 0.89508300 0.68044000 1.0 O O34 1 0.89508300 0.68044000 0.48436100 1.0 O O35 1 0.68044000 0.48436100 0.89508300 1.0