# generated using pymatgen
data_LiV2OF5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.16717300
_cell_length_b   5.49264081
_cell_length_c   11.90728396
_cell_angle_alpha   98.54545628
_cell_angle_beta   102.47850731
_cell_angle_gamma   90.56895724
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiV2OF5
_chemical_formula_sum   'Li3 V6 O3 F15'
_cell_volume   325.98989279
_cell_formula_units_Z   3
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  0.40914200  0.98849100  0.84844200  1
  Li  Li1  1  0.73454700  0.19595200  0.48344600  1
  Li  Li2  1  0.60567900  0.15980800  0.18319300  1
  V  V3  1  0.32121600  0.32256100  0.66871800  1
  V  V4  1  0.18368400  0.17772700  0.33473300  1
  V  V5  1  0.65492700  0.65206400  0.33606300  1
  V  V6  1  0.84981400  0.84041800  0.66931500  1
  V  V7  1  0.51545600  0.49043800  0.00122300  1
  V  V8  1  0.98279500  0.01278600  0.00247800  1
  O  O9  1  0.15658300  0.04814500  0.70434000  1
  O  O10  1  0.49881900  0.37007400  0.36905800  1
  O  O11  1  0.70731400  0.21092800  0.03705000  1
  F  F12  1  0.18069000  0.26918600  0.95205700  1
  F  F13  1  0.05074000  0.55333600  0.71143900  1
  F  F14  1  0.29341500  0.79427300  0.95867600  1
  F  F15  1  0.10673400  0.26126100  0.49829900  1
  F  F16  1  0.22841100  0.08156000  0.16698900  1
  F  F17  1  0.53572700  0.40845300  0.83414000  1
  F  F18  1  0.52082800  0.61089600  0.63096600  1
  F  F19  1  0.38193600  0.88996900  0.38021900  1
  F  F20  1  0.62023600  0.11892900  0.61802900  1
  F  F21  1  0.47029100  0.58092400  0.16702100  1
  F  F22  1  0.77004900  0.91531900  0.83367900  1
  F  F23  1  0.86613000  0.76316000  0.49568400  1
  F  F24  1  0.82749300  0.96515000  0.29535700  1
  F  F25  1  0.83543500  0.72123100  0.04623800  1
  F  F26  1  0.93694600  0.43192600  0.28375700  1
