# generated using pymatgen data_LiNi(PO3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.91297445 _cell_length_b 8.91297445 _cell_length_c 9.55714149 _cell_angle_alpha 58.15737685 _cell_angle_beta 58.15737685 _cell_angle_gamma 48.88458979 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiNi(PO3)4 _chemical_formula_sum 'Li2 Ni2 P8 O24' _cell_volume 466.14841064 _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 0.29804800 0.70195200 0.25000000 1.0 Li Li1 1 0.70195200 0.29804800 0.75000000 1.0 Ni Ni2 1 0.87748400 0.12251600 0.25000000 1.0 Ni Ni3 1 0.12251600 0.87748400 0.75000000 1.0 P P4 1 0.69623400 0.02622100 0.67608700 1.0 P P5 1 0.57425000 0.70592600 0.86429000 1.0 P P6 1 0.29407400 0.42575000 0.63571000 1.0 P P7 1 0.97377900 0.30376600 0.82391300 1.0 P P8 1 0.02622100 0.69623400 0.17608700 1.0 P P9 1 0.70592600 0.57425000 0.36429000 1.0 P P10 1 0.42575000 0.29407400 0.13571000 1.0 P P11 1 0.30376600 0.97377900 0.32391300 1.0 O O12 1 0.66123200 0.84083600 0.82121800 1.0 O O13 1 0.97760000 0.25106800 0.99907300 1.0 O O14 1 0.46973200 0.22448600 0.72970200 1.0 O O15 1 0.17172600 0.59976300 0.71322300 1.0 O O16 1 0.40023700 0.82827400 0.78677700 1.0 O O17 1 0.77551400 0.53026800 0.77029800 1.0 O O18 1 0.74893200 0.02240000 0.50092700 1.0 O O19 1 0.15916400 0.33876800 0.67878200 1.0 O O20 1 0.38490500 0.47780500 0.44450800 1.0 O O21 1 0.47780500 0.38490500 0.94450800 1.0 O O22 1 0.16466500 0.97137200 0.28233800 1.0 O O23 1 0.97137200 0.16466500 0.78233800 1.0 O O24 1 0.02862800 0.83533500 0.21766200 1.0 O O25 1 0.83533500 0.02862800 0.71766200 1.0 O O26 1 0.52219500 0.61509500 0.05549200 1.0 O O27 1 0.61509500 0.52219500 0.55549200 1.0 O O28 1 0.84083600 0.66123200 0.32121800 1.0 O O29 1 0.25106800 0.97760000 0.49907300 1.0 O O30 1 0.22448600 0.46973200 0.22970200 1.0 O O31 1 0.59976300 0.17172600 0.21322300 1.0 O O32 1 0.82827400 0.40023700 0.28677700 1.0 O O33 1 0.53026800 0.77551400 0.27029800 1.0 O O34 1 0.02240000 0.74893200 0.00092700 1.0 O O35 1 0.33876800 0.15916400 0.17878200 1.0