# generated using pymatgen data_Ni4(PO4)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.30501708 _cell_length_b 10.30501708 _cell_length_c 10.30501708 _cell_angle_alpha 142.59886528 _cell_angle_beta 142.59886528 _cell_angle_gamma 53.92773387 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ni4(PO4)3 _chemical_formula_sum 'Ni8 P6 O24' _cell_volume 401.06439207 _cell_formula_units_Z 2 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 Ni Ni0 1 0.87500000 0.37821000 0.00321000 1.0 Ni Ni1 1 0.62179000 0.62500000 0.49679000 1.0 Ni Ni2 1 0.22699800 0.22699800 0.00000000 1.0 Ni Ni3 1 0.12821000 0.12500000 0.50321000 1.0 Ni Ni4 1 0.77300200 0.77300200 0.00000000 1.0 Ni Ni5 1 0.37500000 0.87179000 0.99679000 1.0 Ni Ni6 1 0.52300200 0.02300200 0.50000000 1.0 Ni Ni7 1 0.97699800 0.47699800 0.50000000 1.0 P P8 1 0.52506100 0.12500000 0.90006100 1.0 P P9 1 0.37500000 0.47493900 0.59993900 1.0 P P10 1 0.00000000 0.00000000 0.00000000 1.0 P P11 1 0.22493900 0.62500000 0.09993900 1.0 P P12 1 0.75000000 0.25000000 0.50000000 1.0 P P13 1 0.87500000 0.77506100 0.40006100 1.0 O O14 1 0.90017100 0.76251400 0.74850600 1.0 O O15 1 0.26627100 0.56274300 0.70659700 1.0 O O16 1 0.84982900 0.09833400 0.36234300 1.0 O O17 1 0.89385500 0.68725700 0.20352900 1.0 O O18 1 0.48372900 0.69032600 0.79647100 1.0 O O19 1 0.08517200 0.92144000 0.71476100 1.0 O O20 1 0.85614500 0.55967400 0.29340300 1.0 O O21 1 0.84833400 0.09982900 0.86234300 1.0 O O22 1 0.30967400 0.10614500 0.79340300 1.0 O O23 1 0.44032600 0.73372900 0.29647100 1.0 O O24 1 0.73599100 0.48748600 0.63765700 1.0 O O25 1 0.07856000 0.79332100 0.16373200 1.0 O O26 1 0.20667900 0.37041100 0.28523900 1.0 O O27 1 0.43725700 0.14385500 0.70352900 1.0 O O28 1 0.23748600 0.98599100 0.13765700 1.0 O O29 1 0.67144000 0.33517200 0.21476100 1.0 O O30 1 0.01400900 0.15166600 0.25149400 1.0 O O31 1 0.54332100 0.32856000 0.66373200 1.0 O O32 1 0.51251400 0.15017100 0.24850600 1.0 O O33 1 0.12041100 0.45667900 0.78523900 1.0 O O34 1 0.66482800 0.87958900 0.33626800 1.0 O O35 1 0.31274300 0.51627100 0.20659700 1.0 O O36 1 0.62958900 0.91482800 0.83626800 1.0 O O37 1 0.90166600 0.26400900 0.75149400 1.0