# generated using pymatgen
data_Li4Ni3(OF3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.13312772
_cell_length_b   11.39805759
_cell_length_c   5.15717050
_cell_angle_alpha   94.05711141
_cell_angle_beta   79.97367152
_cell_angle_gamma   98.43890707
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Ni3(OF3)2
_chemical_formula_sum   'Li8 Ni6 O4 F12'
_cell_volume   293.59235663
_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  0.01605900  0.00132000  0.01991800  1
  Li  Li1  1  0.51605600  0.50130400  0.01993900  1
  Li  Li2  1  0.10895300  0.12368400  0.48005500  1
  Li  Li3  1  0.60895300  0.62370000  0.48003900  1
  Li  Li4  1  0.25755000  0.24431300  0.98750600  1
  Li  Li5  1  0.75751600  0.74435800  0.98749800  1
  Li  Li6  1  0.36750400  0.38063600  0.51246700  1
  Li  Li7  1  0.86746900  0.88068400  0.51246900  1
  Ni  Ni8  1  0.06257700  0.56257800  0.74997200  1
  Ni  Ni9  1  0.17956500  0.68192800  0.24882800  1
  Ni  Ni10  1  0.94540000  0.44302700  0.25116100  1
  Ni  Ni11  1  0.56259100  0.06258500  0.75000400  1
  Ni  Ni12  1  0.67980800  0.18206700  0.24900100  1
  Ni  Ni13  1  0.44516000  0.94287600  0.25100600  1
  O  O14  1  0.36155300  0.09152300  0.11001400  1
  O  O15  1  0.86151000  0.59149300  0.10996700  1
  O  O16  1  0.76344900  0.03344600  0.38996500  1
  O  O17  1  0.26349500  0.53347800  0.38999600  1
  F  F18  1  0.91037000  0.15059300  0.88069600  1
  F  F19  1  0.41029300  0.65058900  0.88070400  1
  F  F20  1  0.71468200  0.47441400  0.61928200  1
  F  F21  1  0.21460200  0.97443300  0.61930400  1
  F  F22  1  0.44113000  0.21638400  0.61479200  1
  F  F23  1  0.94117100  0.71635300  0.61477500  1
  F  F24  1  0.18377300  0.40863400  0.88537600  1
  F  F25  1  0.68380700  0.90862300  0.88533300  1
  F  F26  1  0.59385400  0.34454700  0.15471200  1
  F  F27  1  0.09379900  0.84451700  0.15472300  1
  F  F28  1  0.03120900  0.28048400  0.34525500  1
  F  F29  1  0.53114200  0.78042900  0.34524500  1
