# generated using pymatgen data_LiNi(PO3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.28086274 _cell_length_b 7.28086274 _cell_length_c 10.08180810 _cell_angle_alpha 66.72190188 _cell_angle_beta 66.72190188 _cell_angle_gamma 70.23017951 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiNi(PO3)4 _chemical_formula_sum 'Li2 Ni2 P8 O24' _cell_volume 440.35504635 _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 Li Li0 1 0.00000000 0.50000000 0.00000000 1.0 Li Li1 1 0.50000000 0.00000000 0.50000000 1.0 Ni Ni2 1 0.55499000 0.44501000 0.25000000 1.0 Ni Ni3 1 0.44501000 0.55499000 0.75000000 1.0 P P4 1 0.75171600 0.23057600 0.97857400 1.0 P P5 1 0.79578300 0.80889200 0.19523700 1.0 P P6 1 0.19110800 0.20421700 0.30476300 1.0 P P7 1 0.76942400 0.24828400 0.52142600 1.0 P P8 1 0.23057600 0.75171600 0.47857400 1.0 P P9 1 0.80889200 0.79578300 0.69523700 1.0 P P10 1 0.20421700 0.19110800 0.80476300 1.0 P P11 1 0.24828400 0.76942400 0.02142600 1.0 O O12 1 0.77958900 0.31211200 0.08446600 1.0 O O13 1 0.30879900 0.15238700 0.65467000 1.0 O O14 1 0.38119200 0.22444600 0.31941300 1.0 O O15 1 0.96591400 0.19191700 0.84896000 1.0 O O16 1 0.71788400 0.99922800 0.06441700 1.0 O O17 1 0.58731500 0.34271100 0.90474300 1.0 O O18 1 0.00077200 0.28211600 0.43558300 1.0 O O19 1 0.15238700 0.30879900 0.15467000 1.0 O O20 1 0.31211200 0.77958900 0.58446600 1.0 O O21 1 0.65728900 0.41268500 0.59525700 1.0 O O22 1 0.77555400 0.61880800 0.18058700 1.0 O O23 1 0.19191700 0.96591400 0.34896000 1.0 O O24 1 0.80808300 0.03408600 0.65104000 1.0 O O25 1 0.22444600 0.38119200 0.81941300 1.0 O O26 1 0.34271100 0.58731500 0.40474300 1.0 O O27 1 0.68788800 0.22041100 0.41553400 1.0 O O28 1 0.84761300 0.69120100 0.84533000 1.0 O O29 1 0.99922800 0.71788400 0.56441700 1.0 O O30 1 0.41268500 0.65728900 0.09525700 1.0 O O31 1 0.28211600 0.00077200 0.93558300 1.0 O O32 1 0.03408600 0.80808300 0.15104000 1.0 O O33 1 0.61880800 0.77555400 0.68058700 1.0 O O34 1 0.69120100 0.84761300 0.34533000 1.0 O O35 1 0.22041100 0.68788800 0.91553400 1.0