# generated using pymatgen
data_Li3VO3F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.16206500
_cell_length_b   7.77289093
_cell_length_c   7.78838056
_cell_angle_alpha   97.88218925
_cell_angle_beta   102.90545006
_cell_angle_gamma   103.10474612
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3VO3F
_chemical_formula_sum   'Li12 V4 O12 F4'
_cell_volume   290.81444015
_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  0.50287600  0.37008400  0.13289400  1
  Li  Li1  1  0.53463800  0.12644200  0.38354300  1
  Li  Li2  1  0.00000000  0.50000000  0.00000000  1
  Li  Li3  1  0.50000000  0.50000000  0.50000000  1
  Li  Li4  1  0.50000000  0.00000000  0.00000000  1
  Li  Li5  1  0.48546600  0.73474900  0.24790100  1
  Li  Li6  1  0.51453400  0.26525100  0.75209900  1
  Li  Li7  1  0.01015100  0.61621600  0.38438700  1
  Li  Li8  1  0.98984900  0.38378400  0.61561300  1
  Li  Li9  1  0.46536200  0.87355800  0.61645700  1
  Li  Li10  1  0.49712400  0.62991600  0.86710600  1
  Li  Li11  1  0.00000000  0.00000000  0.50000000  1
  V  V12  1  0.98835700  0.26984500  0.24087800  1
  V  V13  1  0.02696000  0.88840800  0.14527200  1
  V  V14  1  0.97304000  0.11159200  0.85472800  1
  V  V15  1  0.01164300  0.73015500  0.75912200  1
  O  O16  1  0.77099700  0.24799600  0.00052200  1
  O  O17  1  0.79513100  0.01522800  0.24810700  1
  O  O18  1  0.21802600  0.12045700  0.10976800  1
  O  O19  1  0.76287600  0.36128400  0.36264100  1
  O  O20  1  0.76077500  0.12632700  0.64779800  1
  O  O21  1  0.23996300  0.47688000  0.24887300  1
  O  O22  1  0.76003700  0.52312000  0.75112700  1
  O  O23  1  0.23922500  0.87367300  0.35220200  1
  O  O24  1  0.23712400  0.63871600  0.63735900  1
  O  O25  1  0.78197400  0.87954300  0.89023200  1
  O  O26  1  0.20486900  0.98477200  0.75189300  1
  O  O27  1  0.22900300  0.75200400  0.99947800  1
  F  F28  1  0.74893900  0.63942900  0.12555700  1
  F  F29  1  0.25469700  0.25405700  0.50157300  1
  F  F30  1  0.74530300  0.74594300  0.49842700  1
  F  F31  1  0.25106100  0.36057100  0.87444300  1
