# generated using pymatgen
data_LiV2OF5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.06878023
_cell_length_b   5.41398125
_cell_length_c   16.78551923
_cell_angle_alpha   84.82008739
_cell_angle_beta   82.39924515
_cell_angle_gamma   62.36588265
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiV2OF5
_chemical_formula_sum   'Li4 V8 O4 F20'
_cell_volume   404.28224320
_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  0.49699129  0.68831764  0.30932621  1
  Li  Li1  1  0.62453115  0.80617325  0.91880852  1
  Li  Li2  1  0.73649295  0.95276235  0.55870864  1
  Li  Li3  1  0.27386881  0.41887386  0.05594304  1
  V  V4  1  0.65937643  0.59757766  0.12741498  1
  V  V5  1  0.73264941  0.76602579  0.74227412  1
  V  V6  1  0.13691590  0.12025520  0.62967687  1
  V  V7  1  0.24521572  0.25230339  0.24299053  1
  V  V8  1  0.89868771  0.86007346  0.37659336  1
  V  V9  1  0.02277278  0.97653997  0.99811139  1
  V  V10  1  0.37311781  0.40215430  0.87460019  1
  V  V11  1  0.48107498  0.51496251  0.49468067  1
  O  O12  1  0.49952674  0.92422501  0.66333997  1
  O  O13  1  0.02872260  0.40354452  0.15962809  1
  O  O14  1  0.26134544  0.66411870  0.41247096  1
  O  O15  1  0.29653815  0.68193864  0.93821511  1
  F  F16  1  0.23742312  0.79154935  0.09460312  1
  F  F17  1  0.15995592  0.81169840  0.56531566  1
  F  F18  1  0.68375696  0.28971592  0.06329701  1
  F  F19  1  0.57024216  0.93359053  0.18426201  1
  F  F20  1  0.52640103  0.53227544  0.77981966  1
  F  F21  1  0.72847852  0.32119347  0.58721268  1
  F  F22  1  0.07397011  0.99189776  0.27845660  1
  F  F23  1  0.78711887  0.75285150  0.02387289  1
  F  F24  1  0.71122549  0.73571674  0.47633770  1
  F  F25  1  0.92229103  0.54694813  0.31427122  1
  F  F26  1  0.05330515  0.45864130  0.68357234  1
  F  F27  1  0.95158099  0.59387549  0.84510574  1
  F  F28  1  0.31102430  0.25480383  0.53139291  1
  F  F29  1  0.48653526  0.05622957  0.33664669  1
  F  F30  1  0.24650302  0.20587654  0.97556716  1
  F  F31  1  0.94790523  0.98874421  0.72184941  1
  F  F32  1  0.48185030  0.46797054  0.22750150  1
  F  F33  1  0.44689223  0.05011534  0.82569664  1
  F  F34  1  0.80336807  0.19486078  0.43532213  1
  F  F35  1  0.77752336  0.15395190  0.90808926  1
