# generated using pymatgen
data_LiNiP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.88422000
_cell_length_b   6.81908300
_cell_length_c   9.35756244
_cell_angle_alpha   69.11652284
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNiP2O7
_chemical_formula_sum   'Li4 Ni4 P8 O28'
_cell_volume   470.04256957
_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  0.12612600  0.66586800  0.53006200  1
  Li  Li1  1  0.37387400  0.16586800  0.03006200  1
  Li  Li2  1  0.62612600  0.83413200  0.96993800  1
  Li  Li3  1  0.87387400  0.33413200  0.46993800  1
  Ni  Ni4  1  0.76772700  0.27495500  0.99815000  1
  Ni  Ni5  1  0.73227300  0.77495500  0.49815000  1
  Ni  Ni6  1  0.26772700  0.22504500  0.50185000  1
  Ni  Ni7  1  0.23227300  0.72504500  0.00185000  1
  P  P8  1  0.45927000  0.65537900  0.29798100  1
  P  P9  1  0.04073000  0.15537900  0.79798100  1
  P  P10  1  0.58471200  0.24102700  0.30083000  1
  P  P11  1  0.08471200  0.25897300  0.19917000  1
  P  P12  1  0.54073000  0.34462100  0.70201900  1
  P  P13  1  0.95927000  0.84462100  0.20201900  1
  P  P14  1  0.41528800  0.75897300  0.69917000  1
  P  P15  1  0.91528800  0.74102700  0.80083000  1
  O  O16  1  0.40799200  0.78595400  0.12967300  1
  O  O17  1  0.06008400  0.69270500  0.14777100  1
  O  O18  1  0.31160900  0.54854200  0.40198000  1
  O  O19  1  0.59768200  0.48485400  0.28933300  1
  O  O20  1  0.59200800  0.21404600  0.87032700  1
  O  O21  1  0.93991600  0.30729500  0.85222900  1
  O  O22  1  0.68839100  0.45145800  0.59802000  1
  O  O23  1  0.40231800  0.51514600  0.71066700  1
  O  O24  1  0.90799200  0.71404600  0.37032700  1
  O  O25  1  0.56008400  0.80729500  0.35222900  1
  O  O26  1  0.81160900  0.95145800  0.09802000  1
  O  O27  1  0.91785300  0.75030600  0.63246800  1
  O  O28  1  0.76500400  0.63271900  0.89843600  1
  O  O29  1  0.09768200  0.01514600  0.21066700  1
  O  O30  1  0.09157200  0.66134500  0.86374300  1
  O  O31  1  0.59157200  0.83865500  0.63625700  1
  O  O32  1  0.26500400  0.86728100  0.60156400  1
  O  O33  1  0.41785300  0.74969400  0.86753200  1
  O  O34  1  0.58214700  0.25030600  0.13246800  1
  O  O35  1  0.73499600  0.13271900  0.39843600  1
  O  O36  1  0.40842800  0.16134500  0.36374300  1
  O  O37  1  0.90842800  0.33865500  0.13625700  1
  O  O38  1  0.90231800  0.98485400  0.78933300  1
  O  O39  1  0.23499600  0.36728100  0.10156400  1
  O  O40  1  0.08214700  0.24969400  0.36753200  1
  O  O41  1  0.18839100  0.04854200  0.90198000  1
  O  O42  1  0.43991600  0.19270500  0.64777100  1
  O  O43  1  0.09200800  0.28595400  0.62967300  1
