# generated using pymatgen
data_LiNiP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.17796900
_cell_length_b   6.98069161
_cell_length_c   7.16124831
_cell_angle_alpha   75.04654950
_cell_angle_beta   65.03973960
_cell_angle_gamma   79.15417497
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNiP2O7
_chemical_formula_sum   'Li2 Ni2 P4 O14'
_cell_volume   269.40201875
_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  0.92539000  0.32978900  0.16550500  1
  Li  Li1  1  0.07461000  0.67021100  0.83449500  1
  Ni  Ni2  1  0.67996400  0.17036100  0.89669200  1
  Ni  Ni3  1  0.32003600  0.82963900  0.10330800  1
  P  P4  1  0.22456000  0.19539600  0.75905300  1
  P  P5  1  0.36676600  0.36259900  0.30167500  1
  P  P6  1  0.63323400  0.63740100  0.69832500  1
  P  P7  1  0.77544000  0.80460400  0.24094700  1
  O  O8  1  0.96703200  0.92951300  0.21819400  1
  O  O9  1  0.39735400  0.07788600  0.86544700  1
  O  O10  1  0.40341600  0.24477000  0.51422900  1
  O  O11  1  0.16638000  0.27666400  0.28688700  1
  O  O12  1  0.11765300  0.38455500  0.84453600  1
  O  O13  1  0.61306100  0.32237600  0.12890400  1
  O  O14  1  0.69503400  0.41805300  0.67960200  1
  O  O15  1  0.30496600  0.58194700  0.32039800  1
  O  O16  1  0.38693900  0.67762400  0.87109600  1
  O  O17  1  0.88234700  0.61544500  0.15546400  1
  O  O18  1  0.83362000  0.72333600  0.71311300  1
  O  O19  1  0.59658400  0.75523000  0.48577100  1
  O  O20  1  0.60264600  0.92211400  0.13455300  1
  O  O21  1  0.03296800  0.07048700  0.78180600  1
