# generated using pymatgen
data_Li2Re2(OF2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.50104494
_cell_length_b   5.50104425
_cell_length_c   20.74046123
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000997
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Re2(OF2)3
_chemical_formula_sum   'Li6 Re6 O9 F18'
_cell_volume   543.54978560
_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  0.43421902  0.44090929  0.14419691  1.0
  Li  Li1  1  0.99330974  0.55909071  0.52246909  1.0
  Li  Li2  1  0.44090929  0.43421902  0.85580309  1.0
  Li  Li3  1  0.55909071  0.99330974  0.47753091  1.0
  Li  Li4  1  0.56578098  0.00669026  0.18913609  1.0
  Li  Li5  1  0.00669026  0.56578098  0.81086391  1.0
  Re  Re6  1  0.77024694  0.10316572  0.04434793  1.0
  Re  Re7  1  0.66708122  0.89683428  0.62231907  1.0
  Re  Re8  1  0.22975306  0.33291878  0.28898607  1.0
  Re  Re9  1  0.89683428  0.66708122  0.37768093  1.0
  Re  Re10  1  0.33291878  0.22975306  0.71101393  1.0
  Re  Re11  1  0.10316572  0.77024694  0.95565207  1.0
  O  O12  1  0.08252885  1.00000000  0.33333300  1.0
  O  O13  1  0.91747115  0.91747115  0.00000000  1.0
  O  O14  1  0.49925233  0.57763898  0.67232982  1.0
  O  O15  1  0.57763898  0.49925233  0.32767018  1.0
  O  O16  1  0.42236102  0.92161335  0.00566382  1.0
  O  O17  1  1.00000000  0.08252885  0.66666700  1.0
  O  O18  1  0.92161335  0.42236102  0.99433618  1.0
  O  O19  1  0.07838665  0.50074767  0.33899682  1.0
  O  O20  1  0.50074767  0.07838665  0.66100318  1.0
  F  F21  1  0.35752038  0.72239530  0.55774080  1.0
  F  F22  1  0.17088303  0.88592136  0.76342982  1.0
  F  F23  1  0.28496267  0.11407864  0.90323718  1.0
  F  F24  1  0.81512322  0.63281465  0.88557873  1.0
  F  F25  1  0.63512508  0.27760470  0.10892620  1.0
  F  F26  1  0.63281465  0.81512322  0.11442127  1.0
  F  F27  1  0.18230857  0.36718535  0.78108827  1.0
  F  F28  1  0.18487678  0.81769143  0.44775427  1.0
  F  F29  1  0.64247962  0.36487492  0.77559220  1.0
  F  F30  1  0.71503733  0.82911697  0.43009682  1.0
  F  F31  1  0.36718535  0.18230857  0.21891173  1.0
  F  F32  1  0.11407864  0.28496267  0.09676282  1.0
  F  F33  1  0.88592136  0.17088303  0.23657018  1.0
  F  F34  1  0.36487492  0.64247962  0.22440780  1.0
  F  F35  1  0.27760470  0.63512508  0.89107380  1.0
  F  F36  1  0.72239530  0.35752038  0.44225920  1.0
  F  F37  1  0.81769143  0.18487678  0.55224573  1.0
  F  F38  1  0.82911697  0.71503733  0.56990318  1.0