# generated using pymatgen
data_LiNiP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.29673878
_cell_length_b   5.29673878
_cell_length_c   4.58207058
_cell_angle_alpha   81.51952263
_cell_angle_beta   81.51952263
_cell_angle_gamma   101.98167347
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNiP2O7
_chemical_formula_sum   'Li1 Ni1 P2 O7'
_cell_volume   122.25132610
_cell_formula_units_Z   1
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  0.48824200  0.51175800  0.00000000  1
  Ni  Ni1  1  0.11854400  0.88145600  0.00000000  1
  P  P2  1  0.57198700  0.00262000  0.41931900  1
  P  P3  1  0.99738000  0.42801300  0.58068100  1
  O  O4  1  0.42859000  0.82666900  0.71510000  1
  O  O5  1  0.39578300  0.10535600  0.21177700  1
  O  O6  1  0.76207500  0.87072300  0.24820000  1
  O  O7  1  0.12927700  0.23792500  0.75180000  1
  O  O8  1  0.17333100  0.57141000  0.28490000  1
  O  O9  1  0.72763600  0.27236400  0.50000000  1
  O  O10  1  0.89464400  0.60421700  0.78822300  1
