# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.29381188
_cell_length_b   14.25845991
_cell_length_c   50.26779630
_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   Ta90
_cell_volume   3794.2939175
_cell_formula_units_Z   90
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  0.502011  0.936601  0.300368  1
  Ta  Ta2  1  0.002011  0.436601  0.300646  1
  Ta  Ta3  1  0.502011  0.777433  0.330258  1
  Ta  Ta4  1  0.002011  0.531492  0.349926  1
  Ta  Ta5  1  0.002011  0.839175  0.400155  1
  Ta  Ta6  1  0.502011  0.600313  0.419070  1
  Ta  Ta7  1  0.002011  0.341710  0.349926  1
  Ta  Ta8  1  0.002011  0.034027  0.400155  1
  Ta  Ta9  1  0.502011  0.095769  0.330258  1
  Ta  Ta10  1  0.502011  0.272889  0.419070  1
  Ta  Ta11  1  0.502011  0.603983  0.362210  1
  Ta  Ta12  1  0.002011  0.638802  0.398977  1
  Ta  Ta13  1  0.002011  0.734222  0.352556  1
  Ta  Ta14  1  0.502011  0.769628  0.388536  1
  Ta  Ta15  1  0.002011  0.234400  0.398977  1
  Ta  Ta16  1  0.002011  0.138980  0.352556  1
  Ta  Ta17  1  0.502011  0.269218  0.362210  1
  Ta  Ta18  1  0.502011  0.103573  0.388536  1
  Ta  Ta19  1  0.002011  0.831401  0.306856  1
  Ta  Ta20  1  0.502011  0.436601  0.332088  1
  Ta  Ta21  1  0.502011  0.936601  0.417294  1
  Ta  Ta22  1  0.002011  0.041801  0.306856  1
  Ta  Ta23  1  0.250608  0.622965  0.308336  1
  Ta  Ta24  1  0.250863  0.436601  0.394453  1
  Ta  Ta25  1  0.251807  0.936601  0.355262  1
  Ta  Ta26  1  0.250608  0.250237  0.308336  1
  Ta  Ta27  1  0.753159  0.436601  0.394453  1
  Ta  Ta28  1  0.753414  0.250237  0.308336  1
  Ta  Ta29  1  0.753414  0.622965  0.308336  1
  Ta  Ta30  1  0.752215  0.936601  0.355262  1
  Ta  Ta31  1  0.502011  0.436601  0.446973  1
  Ta  Ta32  1  0.002011  0.936601  0.447001  1
  Ta  Ta33  1  0.502011  0.272867  0.475062  1
  Ta  Ta34  1  0.002011  0.034259  0.493857  1
  Ta  Ta35  1  0.002011  0.338282  0.543360  1
  Ta  Ta36  1  0.502011  0.099175  0.562687  1
  Ta  Ta37  1  0.002011  0.838943  0.493857  1
  Ta  Ta38  1  0.002011  0.534920  0.543360  1
  Ta  Ta39  1  0.502011  0.600334  0.475062  1
  Ta  Ta40  1  0.502011  0.774027  0.562687  1
  Ta  Ta41  1  0.502011  0.103688  0.505279  1
  Ta  Ta42  1  0.002011  0.138473  0.542409  1
  Ta  Ta43  1  0.002011  0.233518  0.495120  1
  Ta  Ta44  1  0.502011  0.268342  0.532197  1
  Ta  Ta45  1  0.002011  0.734729  0.542409  1
  Ta  Ta46  1  0.002011  0.639684  0.495120  1
  Ta  Ta47  1  0.502011  0.769514  0.505279  1
  Ta  Ta48  1  0.502011  0.604860  0.532197  1
  Ta  Ta49  1  0.002011  0.333029  0.447013  1
  Ta  Ta50  1  0.502011  0.936601  0.476606  1
  Ta  Ta51  1  0.502011  0.436601  0.560329  1
  Ta  Ta52  1  0.002011  0.540173  0.447013  1
  Ta  Ta53  1  0.253317  0.119201  0.446987  1
  Ta  Ta54  1  0.250604  0.936601  0.538306  1
  Ta  Ta55  1  0.250725  0.436601  0.499335  1
  Ta  Ta56  1  0.253317  0.754001  0.446987  1
  Ta  Ta57  1  0.753419  0.936601  0.538306  1
  Ta  Ta58  1  0.750706  0.754001  0.446987  1
  Ta  Ta59  1  0.750706  0.119201  0.446987  1
  Ta  Ta60  1  0.753298  0.436601  0.499335  1
  Ta  Ta61  1  0.502011  0.936601  0.591145  1
  Ta  Ta62  1  0.002011  0.436601  0.589814  1
  Ta  Ta63  1  0.502011  0.773447  0.619029  1
  Ta  Ta64  1  0.002011  0.536552  0.636073  1
  Ta  Ta65  1  0.002011  0.837713  0.689795  1
  Ta  Ta66  1  0.502011  0.585119  0.704854  1
  Ta  Ta67  1  0.002011  0.336650  0.636073  1
  Ta  Ta68  1  0.002011  0.035489  0.689795  1
  Ta  Ta69  1  0.502011  0.099754  0.619029  1
  Ta  Ta70  1  0.502011  0.288083  0.704854  1
  Ta  Ta71  1  0.502011  0.603874  0.648326  1
  Ta  Ta72  1  0.002011  0.630081  0.685082  1
  Ta  Ta73  1  0.002011  0.735005  0.639876  1
  Ta  Ta74  1  0.502011  0.764322  0.675088  1
  Ta  Ta75  1  0.002011  0.243121  0.685082  1
  Ta  Ta76  1  0.002011  0.138197  0.639876  1
  Ta  Ta77  1  0.502011  0.269328  0.648326  1
  Ta  Ta78  1  0.502011  0.108880  0.675088  1
  Ta  Ta79  1  0.002011  0.833183  0.591057  1
  Ta  Ta80  1  0.502011  0.436601  0.618722  1
  Ta  Ta81  1  0.502011  0.936601  0.698038  1
  Ta  Ta82  1  0.002011  0.040019  0.591057  1
  Ta  Ta83  1  0.253158  0.620713  0.590219  1
  Ta  Ta84  1  0.254607  0.436601  0.676698  1
  Ta  Ta85  1  0.248937  0.936601  0.644063  1
  Ta  Ta86  1  0.253158  0.252489  0.590219  1
  Ta  Ta87  1  0.749415  0.436601  0.676698  1
  Ta  Ta88  1  0.750864  0.252489  0.590219  1
  Ta  Ta89  1  0.750864  0.620713  0.590219  1
  Ta  Ta90  1  0.755085  0.936601  0.644063  1
