# generated using pymatgen
data_Li2NiPO4F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.30800600
_cell_length_b   5.34362425
_cell_length_c   7.37958704
_cell_angle_alpha   107.08995663
_cell_angle_beta   108.19144544
_cell_angle_gamma   94.68882634
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2NiPO4F
_chemical_formula_sum   'Li4 Ni2 P2 O8 F2'
_cell_volume   186.57110927
_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  0.23341300  0.58620100  0.15408800  1
  Li  Li1  1  0.44061100  0.13149100  0.84783500  1
  Li  Li2  1  0.50080500  0.99252600  0.48419000  1
  Li  Li3  1  0.80435600  0.44196200  0.82906700  1
  Ni  Ni4  1  0.99563900  0.00100300  0.00663200  1
  Ni  Ni5  1  0.98608400  0.98627100  0.48948800  1
  P  P6  1  0.66138700  0.36806800  0.24306400  1
  P  P7  1  0.33744400  0.62813200  0.76528100  1
  O  O8  1  0.26993000  0.78944200  0.61813700  1
  O  O9  1  0.73555800  0.22192500  0.39709100  1
  O  O10  1  0.32840700  0.32615700  0.66109800  1
  O  O11  1  0.14011100  0.66049200  0.88571500  1
  O  O12  1  0.84366400  0.33488700  0.10920000  1
  O  O13  1  0.36303700  0.25044600  0.08911400  1
  O  O14  1  0.66374500  0.66730200  0.34488700  1
  O  O15  1  0.63048600  0.74685400  0.91385500  1
  F  F16  1  0.84550700  0.08123400  0.73245800  1
  F  F17  1  0.14769800  0.91724200  0.27021200  1
