# generated using pymatgen
data_LiNiPO4F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.20331300
_cell_length_b   5.32098821
_cell_length_c   7.24921998
_cell_angle_alpha   109.02582573
_cell_angle_beta   105.94468990
_cell_angle_gamma   98.64739986
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNiPO4F
_chemical_formula_sum   'Li2 Ni2 P2 O8 F2'
_cell_volume   175.97444586
_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  0.53095300  0.16956100  0.19828000  1
  Li  Li1  1  0.46904700  0.83043900  0.80172000  1
  Ni  Ni2  1  0.00000000  0.00000000  0.00000000  1
  Ni  Ni3  1  0.50000000  0.50000000  0.50000000  1
  P  P4  1  0.92521900  0.59289200  0.76158600  1
  P  P5  1  0.07478100  0.40710800  0.23841400  1
  O  O6  1  0.54879500  0.68020000  0.07579800  1
  O  O7  1  0.96017800  0.99612000  0.34455100  1
  O  O8  1  0.03982200  0.00388000  0.65544900  1
  O  O9  1  0.86348900  0.39729400  0.39359300  1
  O  O10  1  0.45120500  0.31980000  0.92420200  1
  O  O11  1  0.13651100  0.60270600  0.60640700  1
  O  O12  1  0.98814500  0.53752100  0.12236400  1
  O  O13  1  0.01185400  0.46247900  0.87763600  1
  F  F14  1  0.59996700  0.79842700  0.26615800  1
  F  F15  1  0.40003300  0.20157300  0.73384200  1
