# generated using pymatgen
data_LiNi2OF3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.98368397
_cell_length_b   10.68328395
_cell_length_c   5.98373630
_cell_angle_alpha   73.73100558
_cell_angle_beta   120.00609044
_cell_angle_gamma   90.00631868
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNi2OF3
_chemical_formula_sum   'Li4 Ni8 O4 F12'
_cell_volume   313.44024113
_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  0.48921200  0.53234600  0.97842400  1
  Li  Li1  1  0.98921100  0.03234300  0.97842500  1
  Li  Li2  1  0.63578400  0.09265700  0.27157400  1
  Li  Li3  1  0.13578500  0.59265700  0.27157400  1
  Ni  Ni4  1  0.31252700  0.06244200  0.62504300  1
  Ni  Ni5  1  0.81248800  0.56256200  0.62497000  1
  Ni  Ni6  1  0.06248800  0.31250400  0.12499500  1
  Ni  Ni7  1  0.56250500  0.31249600  0.62501300  1
  Ni  Ni8  1  0.06249900  0.31248600  0.62498500  1
  Ni  Ni9  1  0.56251200  0.81250100  0.12500500  1
  Ni  Ni10  1  0.06249800  0.81249700  0.62500600  1
  Ni  Ni11  1  0.56251500  0.81249900  0.62499800  1
  O  O12  1  0.42609400  0.72166200  0.85221900  1
  O  O13  1  0.92612700  0.22156700  0.85231200  1
  O  O14  1  0.69890100  0.90334000  0.39777700  1
  O  O15  1  0.19887200  0.40343500  0.39769100  1
  F  F16  1  0.93333100  0.67938700  0.38721000  1
  F  F17  1  0.43327000  0.17922100  0.38740900  1
  F  F18  1  0.19167500  0.94560100  0.38332800  1
  F  F19  1  0.69175900  0.44577100  0.38345500  1
  F  F20  1  0.95412900  0.17923200  0.38744600  1
  F  F21  1  0.45386300  0.67940500  0.38719400  1
  F  F22  1  0.19166700  0.94561300  0.86279000  1
  F  F23  1  0.69172500  0.44578100  0.86258700  1
  F  F24  1  0.67113300  0.94559600  0.86280500  1
  F  F25  1  0.17087000  0.44576900  0.86255200  1
  F  F26  1  0.43323800  0.17923100  0.86654400  1
  F  F27  1  0.93332200  0.67939900  0.86667100  1
