# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.90670790
_cell_length_b   9.38208443
_cell_length_c   47.70109649
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   108.43494882
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta64
_cell_volume   2507.80895272
_cell_formula_units_Z   64
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
  Ta  Ta1  1  0.043850  0.708065  0.286798  1
  Ta  Ta2  1  0.267615  0.154699  0.314089  1
  Ta  Ta3  1  0.157193  0.434798  0.301408  1
  Ta  Ta4  1  0.928871  0.977389  0.273575  1
  Ta  Ta5  1  0.657193  0.434798  0.301408  1
  Ta  Ta6  1  0.428871  0.977389  0.273575  1
  Ta  Ta7  1  0.543850  0.708065  0.286798  1
  Ta  Ta8  1  0.767615  0.154699  0.314089  1
  Ta  Ta9  1  0.488930  0.597624  0.344642  1
  Ta  Ta10  1  0.711968  0.043327  0.373841  1
  Ta  Ta11  1  0.599990  0.319439  0.358863  1
  Ta  Ta12  1  0.378175  0.876122  0.330218  1
  Ta  Ta13  1  0.099990  0.319439  0.358863  1
  Ta  Ta14  1  0.878175  0.876122  0.330218  1
  Ta  Ta15  1  0.988930  0.597624  0.344642  1
  Ta  Ta16  1  0.211968  0.043327  0.373841  1
  Ta  Ta17  1  0.933625  0.486440  0.403435  1
  Ta  Ta18  1  0.156385  0.931740  0.433007  1
  Ta  Ta19  1  0.045115  0.209302  0.418172  1
  Ta  Ta20  1  0.822762  0.764866  0.388906  1
  Ta  Ta21  1  0.545115  0.209302  0.418172  1
  Ta  Ta22  1  0.322762  0.764866  0.388906  1
  Ta  Ta23  1  0.433625  0.486440  0.403435  1
  Ta  Ta24  1  0.656385  0.931740  0.433007  1
  Ta  Ta25  1  0.378564  0.375876  0.462496  1
  Ta  Ta26  1  0.600944  0.820420  0.492023  1
  Ta  Ta27  1  0.489796  0.098229  0.477266  1
  Ta  Ta28  1  0.267338  0.653548  0.447760  1
  Ta  Ta29  1  0.989796  0.098229  0.477266  1
  Ta  Ta30  1  0.767338  0.653548  0.447760  1
  Ta  Ta31  1  0.878564  0.375876  0.462496  1
  Ta  Ta32  1  0.100944  0.820420  0.492023  1
  Ta  Ta33  1  0.823254  0.264817  0.521545  1
  Ta  Ta34  1  0.045712  0.709499  0.551051  1
  Ta  Ta35  1  0.934486  0.987170  0.536315  1
  Ta  Ta36  1  0.712106  0.542626  0.506788  1
  Ta  Ta37  1  0.434486  0.987170  0.536315  1
  Ta  Ta38  1  0.212106  0.542626  0.506788  1
  Ta  Ta39  1  0.323254  0.264817  0.521545  1
  Ta  Ta40  1  0.545712  0.709499  0.551051  1
  Ta  Ta41  1  0.267935  0.153744  0.580639  1
  Ta  Ta42  1  0.490288  0.598180  0.609904  1
  Ta  Ta43  1  0.379425  0.876606  0.595376  1
  Ta  Ta44  1  0.156665  0.431307  0.565804  1
  Ta  Ta45  1  0.879425  0.876606  0.595376  1
  Ta  Ta46  1  0.656665  0.431307  0.565804  1
  Ta  Ta47  1  0.767935  0.153744  0.580639  1
  Ta  Ta48  1  0.990288  0.598180  0.609904  1
  Ta  Ta49  1  0.713060  0.043608  0.639948  1
  Ta  Ta50  1  0.934875  0.486925  0.668593  1
  Ta  Ta51  1  0.824120  0.765422  0.654169  1
  Ta  Ta52  1  0.601082  0.319719  0.624970  1
  Ta  Ta53  1  0.324120  0.765422  0.654169  1
  Ta  Ta54  1  0.101082  0.319719  0.624970  1
  Ta  Ta55  1  0.213060  0.043608  0.639948  1
  Ta  Ta56  1  0.434875  0.486925  0.668593  1
  Ta  Ta57  1  0.155857  0.928249  0.697403  1
  Ta  Ta58  1  0.384179  0.385658  0.725235  1
  Ta  Ta59  1  0.269200  0.654981  0.712013  1
  Ta  Ta60  1  0.045435  0.208347  0.684722  1
  Ta  Ta61  1  0.769200  0.654981  0.712013  1
  Ta  Ta62  1  0.545435  0.208347  0.684722  1
  Ta  Ta63  1  0.655857  0.928249  0.697403  1
  Ta  Ta64  1  0.884179  0.385658  0.725235  1
