# generated using pymatgen
data_LiV3(O2F)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.90295500
_cell_length_b   8.66088500
_cell_length_c   10.29892000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiV3(O2F)2
_chemical_formula_sum   'Li4 V12 O16 F8'
_cell_volume   437.33261193
_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  0.95584100  0.25000000  0.71967200  1
  Li  Li1  1  0.54415900  0.25000000  0.21967200  1
  Li  Li2  1  0.45584100  0.75000000  0.78032800  1
  Li  Li3  1  0.04415900  0.75000000  0.28032800  1
  V  V4  1  0.03742400  0.75000000  0.60051300  1
  V  V5  1  0.01197400  0.92489500  0.85843100  1
  V  V6  1  0.01197400  0.57510500  0.85843100  1
  V  V7  1  0.48802600  0.92489500  0.35843100  1
  V  V8  1  0.48802600  0.57510500  0.35843100  1
  V  V9  1  0.46257600  0.75000000  0.10051300  1
  V  V10  1  0.53742400  0.25000000  0.89948700  1
  V  V11  1  0.51197400  0.42489500  0.64156900  1
  V  V12  1  0.51197400  0.07510500  0.64156900  1
  V  V13  1  0.98802600  0.42489500  0.14156900  1
  V  V14  1  0.98802600  0.07510500  0.14156900  1
  V  V15  1  0.96257600  0.25000000  0.39948700  1
  O  O16  1  0.73792200  0.25000000  0.56155900  1
  O  O17  1  0.74503800  0.41819200  0.80094300  1
  O  O18  1  0.74503800  0.08180800  0.80094300  1
  O  O19  1  0.82534800  0.75000000  0.76739500  1
  O  O20  1  0.67465200  0.75000000  0.26739500  1
  O  O21  1  0.75496200  0.41819200  0.30094300  1
  O  O22  1  0.75496200  0.08180800  0.30094300  1
  O  O23  1  0.76207800  0.25000000  0.06155900  1
  O  O24  1  0.23792200  0.75000000  0.93844100  1
  O  O25  1  0.24503800  0.58180800  0.69905700  1
  O  O26  1  0.24503800  0.91819200  0.69905700  1
  O  O27  1  0.32534800  0.25000000  0.73260500  1
  O  O28  1  0.17465200  0.25000000  0.23260500  1
  O  O29  1  0.25496200  0.91819200  0.19905700  1
  O  O30  1  0.25496200  0.58180800  0.19905700  1
  O  O31  1  0.26207800  0.75000000  0.43844100  1
  F  F32  1  0.76616100  0.91146800  0.03170500  1
  F  F33  1  0.76616100  0.58853200  0.03170500  1
  F  F34  1  0.73383900  0.91146800  0.53170500  1
  F  F35  1  0.73383900  0.58853200  0.53170500  1
  F  F36  1  0.26616100  0.41146800  0.46829500  1
  F  F37  1  0.26616100  0.08853200  0.46829500  1
  F  F38  1  0.23383900  0.41146800  0.96829500  1
  F  F39  1  0.23383900  0.08853200  0.96829500  1
