# generated using pymatgen
data_LiNi2(SO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.73627100
_cell_length_b   8.46303000
_cell_length_c   14.71520077
_cell_angle_alpha   55.50483070
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNi2(SO4)3
_chemical_formula_sum   'Li4 Ni8 S12 O48'
_cell_volume   896.67910159
_cell_formula_units_Z   4
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  0.78239900  0.99125800  0.32131400  1
  Li  Li1  1  0.28239900  0.00874200  0.17868600  1
  Li  Li2  1  0.71760100  0.99125800  0.82131400  1
  Li  Li3  1  0.21760100  0.00874200  0.67868600  1
  Ni  Ni4  1  0.53356800  0.36635800  0.88317500  1
  Ni  Ni5  1  0.96210900  0.14351200  0.10928800  1
  Ni  Ni6  1  0.03356800  0.63364200  0.61682500  1
  Ni  Ni7  1  0.46210900  0.85648800  0.39071200  1
  Ni  Ni8  1  0.53789100  0.14351200  0.60928800  1
  Ni  Ni9  1  0.96643200  0.36635800  0.38317500  1
  Ni  Ni10  1  0.03789100  0.85648800  0.89071200  1
  Ni  Ni11  1  0.46643200  0.63364200  0.11682500  1
  S  S12  1  0.25086200  0.45700600  0.00681200  1
  S  S13  1  0.38342400  0.74648800  0.64970100  1
  S  S14  1  0.11159600  0.03592500  0.35416100  1
  S  S15  1  0.61159600  0.96407500  0.14583900  1
  S  S16  1  0.88342400  0.25351200  0.85029900  1
  S  S17  1  0.75086200  0.54299400  0.49318800  1
  S  S18  1  0.24913800  0.45700600  0.50681200  1
  S  S19  1  0.11657600  0.74648800  0.14970100  1
  S  S20  1  0.38840400  0.03592500  0.85416100  1
  S  S21  1  0.88840400  0.96407500  0.64583900  1
  S  S22  1  0.61657600  0.25351200  0.35029900  1
  S  S23  1  0.74913800  0.54299400  0.99318800  1
  O  O24  1  0.86805500  0.39770900  0.05975000  1
  O  O25  1  0.87534400  0.81510800  0.62250700  1
  O  O26  1  0.58314600  0.10839100  0.32456300  1
  O  O27  1  0.69029000  0.53067800  0.90258000  1
  O  O28  1  0.37345000  0.48305100  0.93045900  1
  O  O29  1  0.21488600  0.71225900  0.67189100  1
  O  O30  1  0.41666400  0.83143300  0.53297100  1
  O  O31  1  0.99271400  0.09211700  0.26775600  1
  O  O32  1  0.18249600  0.26065300  0.06157000  1
  O  O33  1  0.26187800  0.01529800  0.31323500  1
  O  O34  1  0.06370200  0.84972600  0.45337000  1
  O  O35  1  0.47555100  0.57178600  0.72006400  1
  O  O36  1  0.97555100  0.42821400  0.77993600  1
  O  O37  1  0.56370200  0.15027400  0.04663000  1
  O  O38  1  0.76187800  0.98470200  0.18676500  1
  O  O39  1  0.68249600  0.73934700  0.43843000  1
  O  O40  1  0.91666400  0.16856700  0.96702900  1
  O  O41  1  0.49271400  0.90788300  0.23224400  1
  O  O42  1  0.71488600  0.28774100  0.82810900  1
  O  O43  1  0.87345000  0.51694900  0.56954100  1
  O  O44  1  0.19029000  0.46932200  0.59742000  1
  O  O45  1  0.37534400  0.18489200  0.87749300  1
  O  O46  1  0.08314600  0.89160900  0.17543700  1
  O  O47  1  0.36805500  0.60229100  0.44025000  1
  O  O48  1  0.63194500  0.39770900  0.55975000  1
  O  O49  1  0.91685400  0.10839100  0.82456300  1
  O  O50  1  0.62465600  0.81510800  0.12250700  1
  O  O51  1  0.80971000  0.53067800  0.40258000  1
  O  O52  1  0.12655000  0.48305100  0.43045900  1
  O  O53  1  0.28511400  0.71225900  0.17189100  1
  O  O54  1  0.50728600  0.09211700  0.76775600  1
  O  O55  1  0.08333600  0.83143300  0.03297100  1
  O  O56  1  0.31750400  0.26065300  0.56157000  1
  O  O57  1  0.23812200  0.01529800  0.81323500  1
  O  O58  1  0.43629800  0.84972600  0.95337000  1
  O  O59  1  0.02444900  0.57178600  0.22006400  1
  O  O60  1  0.52444900  0.42821400  0.27993600  1
  O  O61  1  0.93629800  0.15027400  0.54663000  1
  O  O62  1  0.73812200  0.98470200  0.68676500  1
  O  O63  1  0.81750400  0.73934700  0.93843000  1
  O  O64  1  0.00728600  0.90788300  0.73224400  1
  O  O65  1  0.58333600  0.16856700  0.46702900  1
  O  O66  1  0.78511400  0.28774100  0.32810900  1
  O  O67  1  0.62655000  0.51694900  0.06954100  1
  O  O68  1  0.30971000  0.46932200  0.09742000  1
  O  O69  1  0.41685400  0.89160900  0.67543700  1
  O  O70  1  0.12465600  0.18489200  0.37749300  1
  O  O71  1  0.13194500  0.60229100  0.94025000  1
