# generated using pymatgen
data_LiNi(SO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.42321300
_cell_length_b   8.45059087
_cell_length_c   8.98515279
_cell_angle_alpha   62.29695669
_cell_angle_beta   62.37784744
_cell_angle_gamma   60.14727473
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNi(SO4)2
_chemical_formula_sum   'Li3 Ni3 S6 O24'
_cell_volume   468.12235977
_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
  Li  Li0  1  0.16163500  0.15359800  0.55251100  1
  Li  Li1  1  0.18096600  0.77155900  0.63189400  1
  Li  Li2  1  0.77246300  0.41785600  0.63001200  1
  Ni  Ni3  1  0.35507200  0.35191000  0.93664400  1
  Ni  Ni4  1  0.64147800  0.64551900  0.06868300  1
  Ni  Ni5  1  0.84733700  0.84980200  0.45288300  1
  S  S6  1  0.03747000  0.46621000  0.75177900  1
  S  S7  1  0.46362300  0.74644100  0.74952400  1
  S  S8  1  0.74833600  0.03627300  0.74758900  1
  S  S9  1  0.24726000  0.95600000  0.24710600  1
  S  S10  1  0.54587200  0.24883400  0.24863200  1
  S  S11  1  0.95646000  0.54951600  0.24707600  1
  O  O12  1  0.10532200  0.51476200  0.08293400  1
  O  O13  1  0.29867900  0.10435600  0.08387300  1
  O  O14  1  0.00152600  0.34812700  0.69947500  1
  O  O15  1  0.52291700  0.29603100  0.07680100  1
  O  O16  1  0.02822500  0.65897400  0.60981900  1
  O  O17  1  0.23345300  0.37966100  0.76679700  1
  O  O18  1  0.37815400  0.61948800  0.75990200  1
  O  O19  1  0.34078400  0.94700200  0.69928000  1
  O  O20  1  0.63082200  0.23656400  0.75966300  1
  O  O21  1  0.04352400  0.98659300  0.28629100  1
  O  O22  1  0.26838900  0.96142500  0.40116600  1
  O  O23  1  0.35882200  0.27866100  0.38891900  1
  O  O24  1  0.65757600  0.70394800  0.61024500  1
  O  O25  1  0.71343400  0.02729800  0.60359700  1
  O  O26  1  0.95448900  0.00059200  0.70221700  1
  O  O27  1  0.37421700  0.76018300  0.23087800  1
  O  O28  1  0.67649900  0.04480200  0.29090500  1
  O  O29  1  0.63102300  0.37536900  0.23400400  1
  O  O30  1  0.75940800  0.63452200  0.23126200  1
  O  O31  1  0.96235900  0.36907000  0.39909700  1
  O  O32  1  0.48889500  0.68824000  0.92156800  1
  O  O33  1  0.98529600  0.68282400  0.28866500  1
  O  O34  1  0.68836400  0.89909200  0.91846700  1
  O  O35  1  0.89324800  0.49410100  0.92104000  1
