# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.24372548
_cell_length_b   16.68177475
_cell_length_c   54.93565786
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta72
_cell_volume   2972.62875223
_cell_formula_units_Z   72
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  0.640562  0.627594  0.245813  1
  Ta  Ta2  1  0.640562  0.240972  0.268959  1
  Ta  Ta3  1  0.640562  0.858488  0.289927  1
  Ta  Ta4  1  1.140562  0.358488  0.289927  1
  Ta  Ta5  1  1.140562  0.127594  0.245813  1
  Ta  Ta6  1  1.140562  0.740972  0.268959  1
  Ta  Ta7  1  1.140562  0.549402  0.279454  1
  Ta  Ta8  1  1.140562  0.309616  0.235228  1
  Ta  Ta9  1  1.140562  0.935721  0.255356  1
  Ta  Ta10  1  0.640562  0.435721  0.255356  1
  Ta  Ta11  1  0.640562  0.049402  0.279454  1
  Ta  Ta12  1  0.640562  0.809616  0.235228  1
  Ta  Ta13  1  0.640562  0.472396  0.314220  1
  Ta  Ta14  1  0.640562  0.088041  0.338720  1
  Ta  Ta15  1  0.640562  0.704397  0.362611  1
  Ta  Ta16  1  1.140562  0.204397  0.362611  1
  Ta  Ta17  1  1.140562  -0.027604  0.314220  1
  Ta  Ta18  1  1.140562  0.588041  0.338720  1
  Ta  Ta19  1  1.140562  0.396587  0.350536  1
  Ta  Ta20  1  1.140562  0.164082  0.302828  1
  Ta  Ta21  1  1.140562  0.781182  0.326558  1
  Ta  Ta22  1  0.640562  0.281182  0.326558  1
  Ta  Ta23  1  0.640562  0.896587  0.350536  1
  Ta  Ta24  1  0.640562  0.664082  0.302828  1
  Ta  Ta25  1  0.640562  0.320143  0.386582  1
  Ta  Ta26  1  0.640562  0.935774  0.410606  1
  Ta  Ta27  1  0.640562  0.551580  0.434585  1
  Ta  Ta28  1  1.140562  0.051580  0.434585  1
  Ta  Ta29  1  1.140562  0.820143  0.386582  1
  Ta  Ta30  1  1.140562  0.435774  0.410606  1
  Ta  Ta31  1  1.140562  0.243704  0.422580  1
  Ta  Ta32  1  1.140562  0.012060  0.374652  1
  Ta  Ta33  1  1.140562  0.627959  0.398605  1
  Ta  Ta34  1  0.640562  0.127959  0.398605  1
  Ta  Ta35  1  0.640562  0.743704  0.422580  1
  Ta  Ta36  1  0.640562  0.512060  0.374652  1
  Ta  Ta37  1  0.640562  0.167300  0.458588  1
  Ta  Ta38  1  0.640562  0.783044  0.482562  1
  Ta  Ta39  1  0.640562  0.398943  0.506516  1
  Ta  Ta40  1  1.140562  0.898943  0.506516  1
  Ta  Ta41  1  1.140562  0.667300  0.458588  1
  Ta  Ta42  1  1.140562  0.283044  0.482562  1
  Ta  Ta43  1  1.140562  0.090860  0.494586  1
  Ta  Ta44  1  1.140562  0.859424  0.446583  1
  Ta  Ta45  1  1.140562  0.475229  0.470562  1
  Ta  Ta46  1  0.640562  -0.024771  0.470562  1
  Ta  Ta47  1  0.640562  0.590860  0.494586  1
  Ta  Ta48  1  0.640562  0.359424  0.446583  1
  Ta  Ta49  1  0.640562  0.014417  0.530631  1
  Ta  Ta50  1  0.640562  0.629821  0.554609  1
  Ta  Ta51  1  0.640562  0.246921  0.578340  1
  Ta  Ta52  1  1.140562  0.746921  0.578340  1
  Ta  Ta53  1  1.140562  0.514417  0.530631  1
  Ta  Ta54  1  1.140562  0.129821  0.554609  1
  Ta  Ta55  1  1.140562  0.938607  0.566947  1
  Ta  Ta56  1  1.140562  0.706606  0.518557  1
  Ta  Ta57  1  1.140562  0.322962  0.542448  1
  Ta  Ta58  1  0.640562  0.822962  0.542448  1
  Ta  Ta59  1  0.640562  0.438607  0.566947  1
  Ta  Ta60  1  0.640562  0.206606  0.518557  1
  Ta  Ta61  1  0.640562  0.861601  0.601713  1
  Ta  Ta62  1  0.640562  0.475283  0.625812  1
  Ta  Ta63  1  0.640562  0.101387  0.645940  1
  Ta  Ta64  1  1.140562  0.601387  0.645940  1
  Ta  Ta65  1  1.140562  0.361601  0.601713  1
  Ta  Ta66  1  1.140562  -0.024717  0.625812  1
  Ta  Ta67  1  1.140562  0.783409  0.635355  1
  Ta  Ta68  1  1.140562  0.552515  0.591241  1
  Ta  Ta69  1  1.140562  0.170031  0.612209  1
  Ta  Ta70  1  0.640562  0.670031  0.612209  1
  Ta  Ta71  1  0.640562  0.283409  0.635355  1
  Ta  Ta72  1  0.640562  0.052515  0.591241  1
