# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.19901080
_cell_length_b   15.04513149
_cell_length_c   48.98336322
_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   3094.50778488
_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  0.500584  0.429572  0.344973  1
  Ta  Ta2  1  0.500584  0.199282  0.299378  1
  Ta  Ta3  1  0.500584  0.811937  0.320606  1
  Ta  Ta4  1  0.000584  0.696828  0.300067  1
  Ta  Ta5  1  0.000584  0.313163  0.320775  1
  Ta  Ta6  1  0.000584  0.927992  0.343216  1
  Ta  Ta7  1  0.000584  0.504576  0.309039  1
  Ta  Ta8  1  0.000584  0.120503  0.332127  1
  Ta  Ta9  1  0.000584  0.737149  0.356401  1
  Ta  Ta10  1  0.500584  0.620765  0.332099  1
  Ta  Ta11  1  0.500584  0.388732  0.288627  1
  Ta  Ta12  1  0.500584  0.008404  0.310816  1
  Ta  Ta13  1  0.500584  0.274121  0.416439  1
  Ta  Ta14  1  0.500584  0.043447  0.368262  1
  Ta  Ta15  1  0.500584  0.659056  0.392101  1
  Ta  Ta16  1  0.000584  0.544272  0.368202  1
  Ta  Ta17  1  0.000584  0.158734  0.392281  1
  Ta  Ta18  1  0.000584  0.774143  0.415966  1
  Ta  Ta19  1  0.000584  0.351661  0.380628  1
  Ta  Ta20  1  0.000584  0.966012  0.403686  1
  Ta  Ta21  1  0.000584  0.581788  0.428130  1
  Ta  Ta22  1  0.500584  0.466884  0.404455  1
  Ta  Ta23  1  0.500584  0.236350  0.356844  1
  Ta  Ta24  1  0.500584  0.851464  0.379624  1
  Ta  Ta25  1  0.500584  0.119177  0.487815  1
  Ta  Ta26  1  0.500584  0.888992  0.439697  1
  Ta  Ta27  1  0.500584  0.504390  0.464182  1
  Ta  Ta28  1  0.000584  0.389327  0.440349  1
  Ta  Ta29  1  0.000584  0.003948  0.463691  1
  Ta  Ta30  1  0.000584  0.619341  0.487964  1
  Ta  Ta31  1  0.000584  0.196605  0.452102  1
  Ta  Ta32  1  0.000584  0.811672  0.475752  1
  Ta  Ta33  1  0.000584  0.426974  0.500145  1
  Ta  Ta34  1  0.500584  0.311870  0.476185  1
  Ta  Ta35  1  0.500584  0.081329  0.428003  1
  Ta  Ta36  1  0.500584  0.696692  0.451942  1
  Ta  Ta37  1  0.500584  0.964292  0.559382  1
  Ta  Ta38  1  0.500584  0.734277  0.511767  1
  Ta  Ta39  1  0.500584  0.349670  0.536039  1
  Ta  Ta40  1  0.000584  0.234441  0.511915  1
  Ta  Ta41  1  0.000584  0.849228  0.535549  1
  Ta  Ta42  1  0.000584  0.464626  0.560034  1
  Ta  Ta43  1  0.000584  0.041748  0.523545  1
  Ta  Ta44  1  0.000584  0.656926  0.547788  1
  Ta  Ta45  1  0.000584  0.272289  0.571727  1
  Ta  Ta46  1  0.500584  0.157013  0.547628  1
  Ta  Ta47  1  0.500584  0.926644  0.499586  1
  Ta  Ta48  1  0.500584  0.541946  0.523978  1
  Ta  Ta49  1  0.500584  0.809346  0.631529  1
  Ta  Ta50  1  0.500584  0.579475  0.583764  1
  Ta  Ta51  1  0.500584  0.194884  0.607449  1
  Ta  Ta52  1  0.000584  0.079497  0.583292  1
  Ta  Ta53  1  0.000584  0.694562  0.607629  1
  Ta  Ta54  1  0.000584  0.310171  0.631469  1
  Ta  Ta55  1  0.000584  0.886735  0.595275  1
  Ta  Ta56  1  0.000584  0.502154  0.620106  1
  Ta  Ta57  1  0.000584  0.117268  0.642887  1
  Ta  Ta58  1  0.500584  1.001957  0.619103  1
  Ta  Ta59  1  0.500584  0.771830  0.571600  1
  Ta  Ta60  1  0.500584  0.387606  0.596045  1
  Ta  Ta61  1  0.500584  0.656791  0.699663  1
  Ta  Ta62  1  0.500584  0.425626  0.656514  1
  Ta  Ta63  1  0.500584  0.040456  0.678956  1
  Ta  Ta64  1  0.000584  0.924046  0.654757  1
  Ta  Ta65  1  0.000584  0.541681  0.679125  1
  Ta  Ta66  1  0.000584  0.154336  0.700352  1
  Ta  Ta67  1  0.000584  0.732853  0.667632  1
  Ta  Ta68  1  0.000584  0.345215  0.688915  1
  Ta  Ta69  1  0.000584  0.964886  0.711104  1
  Ta  Ta70  1  0.500584  0.849042  0.690691  1
  Ta  Ta71  1  0.500584  0.616469  0.643329  1
  Ta  Ta72  1  0.500584  0.233115  0.667603  1
