# generated using pymatgen
data_LiV2OF5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.31163000
_cell_length_b   5.52418370
_cell_length_c   17.15506672
_cell_angle_alpha   84.66194786
_cell_angle_beta   81.78222298
_cell_angle_gamma   61.29242991
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiV2OF5
_chemical_formula_sum   'Li4 V8 O4 F20'
_cell_volume   436.79253302
_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  0.20034600  0.11043600  0.43737700  1
  Li  Li1  1  0.62976600  0.77828200  0.92759300  1
  Li  Li2  1  0.28256600  0.39662000  0.06443900  1
  Li  Li3  1  0.35956900  0.55707000  0.67303500  1
  V  V4  1  0.64826800  0.60675300  0.13181500  1
  V  V5  1  0.22688000  0.26571200  0.24541200  1
  V  V6  1  0.86130000  0.89912300  0.37502500  1
  V  V7  1  0.76436700  0.73261300  0.74630400  1
  V  V8  1  0.11402200  0.15009900  0.62844100  1
  V  V9  1  0.02056400  0.97779600  0.99814100  1
  V  V10  1  0.51466100  0.48329100  0.49455800  1
  V  V11  1  0.37594200  0.39114300  0.87702900  1
  O  O12  1  0.02627500  0.40951500  0.15565500  1
  O  O13  1  0.04947400  0.44334900  0.68726600  1
  O  O14  1  0.79579300  0.19241100  0.43662600  1
  O  O15  1  0.30154400  0.68592600  0.93641700  1
  F  F16  1  0.23883600  0.79965200  0.08920100  1
  F  F17  1  0.69283600  0.30092600  0.06059100  1
  F  F18  1  0.22378000  0.80163900  0.56939900  1
  F  F19  1  0.54000300  0.95212400  0.17933400  1
  F  F20  1  0.69516000  0.34536000  0.59749800  1
  F  F21  1  0.51625900  0.52720700  0.77534100  1
  F  F22  1  0.79099400  0.76144800  0.02489900  1
  F  F23  1  0.03205200  0.03453200  0.28298200  1
  F  F24  1  0.70740600  0.72697300  0.46412100  1
  F  F25  1  0.51871600  0.92051200  0.66274700  1
  F  F26  1  0.94688500  0.56959100  0.31691800  1
  F  F27  1  0.95999100  0.58090500  0.84755700  1
  F  F28  1  0.25730900  0.27826400  0.52668700  1
  F  F29  1  0.44782800  0.10130900  0.34336600  1
  F  F30  1  0.26238900  0.70656800  0.41494900  1
  F  F31  1  0.24980200  0.20255100  0.97376200  1
  F  F32  1  0.00058200  0.93932200  0.71496200  1
  F  F33  1  0.46049800  0.46258300  0.21942600  1
  F  F34  1  0.47795800  0.03778200  0.82270900  1
  F  F35  1  0.77453100  0.15929900  0.90976400  1
