# generated using pymatgen
data_Li3V2S2(O4F3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.15436000
_cell_length_b   7.82977637
_cell_length_c   10.36942710
_cell_angle_alpha   91.62220561
_cell_angle_beta   90.72405802
_cell_angle_gamma   90.54742184
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3V2S2(O4F3)2
_chemical_formula_sum   'Li6 V4 S4 O16 F12'
_cell_volume   580.55689055
_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  0.27961400  0.11549000  0.29039400  1
  Li  Li1  1  0.25013500  0.60682000  0.78349700  1
  Li  Li2  1  0.70557100  0.42012300  0.22711600  1
  Li  Li3  1  0.71203800  0.91766600  0.25070000  1
  Li  Li4  1  0.78278400  0.42587700  0.74837300  1
  Li  Li5  1  0.77597800  0.92115100  0.73211300  1
  V  V6  1  0.99822900  0.49229800  0.49383800  1
  V  V7  1  0.99963700  0.00099400  0.99837300  1
  V  V8  1  0.49947100  0.50037600  0.49747900  1
  V  V9  1  0.49967400  0.99224700  0.99367300  1
  S  S10  1  0.27604300  0.33105000  0.01097100  1
  S  S11  1  0.23351700  0.83120300  0.50925000  1
  S  S12  1  0.74189500  0.15695300  0.50146300  1
  S  S13  1  0.75072700  0.65725100  0.00065400  1
  O  O14  1  0.11490100  0.21433200  0.05978400  1
  O  O15  1  0.09371400  0.71509600  0.43817000  1
  O  O16  1  0.19558400  0.45201500  0.92226500  1
  O  O17  1  0.15000900  0.91406000  0.62038100  1
  O  O18  1  0.36971700  0.40299600  0.12455100  1
  O  O19  1  0.31986800  0.94211200  0.41593500  1
  O  O20  1  0.40572000  0.21331500  0.93626200  1
  O  O21  1  0.38843100  0.71057800  0.56243300  1
  O  O22  1  0.59546900  0.27374000  0.43871400  1
  O  O23  1  0.61025200  0.77410000  0.06696900  1
  O  O24  1  0.65640500  0.05674500  0.60166000  1
  O  O25  1  0.66604300  0.55700600  0.89418800  1
  O  O26  1  0.82181000  0.05543300  0.39638300  1
  O  O27  1  0.83695200  0.55510700  0.09989300  1
  O  O28  1  0.88539000  0.27507300  0.56760000  1
  O  O29  1  0.89663800  0.77495200  0.93896400  1
  F  F30  1  0.97051900  0.06394500  0.83063600  1
  F  F31  1  0.03406700  0.54530800  0.68010800  1
  F  F32  1  0.25859300  0.39253000  0.47334300  1
  F  F33  1  0.23687000  0.89249100  0.98069700  1
  F  F34  1  0.47903300  0.04763400  0.18006400  1
  F  F35  1  0.53241200  0.57116400  0.33252900  1
  F  F36  1  0.52095600  0.43050500  0.66660100  1
  F  F37  1  0.54994600  0.90449200  0.82617600  1
  F  F38  1  0.75559800  0.10371400  0.01760300  1
  F  F39  1  0.74632600  0.60330200  0.52542800  1
  F  F40  1  0.93596400  0.40693600  0.32638900  1
  F  F41  1  0.97355500  0.93404400  0.16670800  1
