# generated using pymatgen
data_LiTaGeO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.53518080
_cell_length_b   7.58133869
_cell_length_c   8.03614041
_cell_angle_alpha   90.00010776
_cell_angle_beta   90.00002422
_cell_angle_gamma   119.64471365
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTaGeO5
_chemical_formula_sum   'Li4 Ta4 Ge4 O20'
_cell_volume   398.98947146
_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  0.54761154  0.25048455  0.55857512  1
  Li  Li1  1  0.45238362  0.74952230  0.44143888  1
  Li  Li2  1  0.95238304  0.74951985  0.05856396  1
  Li  Li3  1  0.04761985  0.25049698  0.94142323  1
  Ta  Ta4  1  0.73907287  0.74972549  0.73977747  1
  Ta  Ta5  1  0.76085755  0.25027152  0.23982580  1
  Ta  Ta6  1  0.23907301  0.74972566  0.76022244  1
  Ta  Ta7  1  0.26085816  0.25027224  0.26017419  1
  Ge  Ge8  1  0.49131182  0.25020709  0.88675074  1
  Ge  Ge9  1  0.99131086  0.25020563  0.61324913  1
  Ge  Ge10  1  0.50872303  0.74979343  0.11324703  1
  Ge  Ge11  1  0.00872317  0.74979433  0.38675288  1
  O  O12  1  0.80404402  0.25557734  0.48918003  1
  O  O13  1  0.69595200  0.74444140  0.98916561  1
  O  O14  1  0.32138648  0.75306862  0.98724695  1
  O  O15  1  0.60029230  0.94885313  0.25698724  1
  O  O16  1  0.49945456  0.75146933  0.68017125  1
  O  O17  1  0.67859258  0.24691871  0.01276561  1
  O  O18  1  -0.00054609  0.75146848  0.81982847  1
  O  O19  1  0.50054607  0.24852266  0.31982494  1
  O  O20  1  0.10180941  0.44873554  0.75697608  1
  O  O21  1  0.82138680  0.75306981  0.51275323  1
  O  O22  1  0.17859215  0.24691772  0.48723410  1
  O  O23  1  0.10029260  0.94885324  0.24301196  1
  O  O24  1  0.30404502  0.25557929  0.01082026  1
  O  O25  1  0.00054674  0.24852359  0.18017525  1
  O  O26  1  0.39822165  0.55126651  0.25698500  1
  O  O27  1  0.89973622  0.05113659  0.75697749  1
  O  O28  1  0.19595256  0.74444329  0.51083409  1
  O  O29  1  0.39973589  0.05113627  0.74302348  1
  O  O30  1  0.89822158  0.55126633  0.24301575  1
  O  O31  1  0.60180897  0.44873511  0.74302233  1
