# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.33151121
_cell_length_b   14.26318756
_cell_length_c   50.22803753
_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   3819.55818423
_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  0.502316  0.770080  0.361857  1
  Ta  Ta2  1  0.002316  0.337440  0.399866  1
  Ta  Ta3  1  0.252449  0.436387  0.355379  1
  Ta  Ta4  1  0.002316  0.639810  0.351992  1
  Ta  Ta5  1  0.002316  0.734643  0.399853  1
  Ta  Ta6  1  0.502316  0.936387  0.332181  1
  Ta  Ta7  1  0.250764  0.120730  0.308475  1
  Ta  Ta8  1  0.753868  0.752043  0.308475  1
  Ta  Ta9  1  0.002316  0.032991  0.351287  1
  Ta  Ta10  1  0.002316  0.839782  0.351287  1
  Ta  Ta11  1  0.002316  0.536177  0.307083  1
  Ta  Ta12  1  0.502316  0.436387  0.301916  1
  Ta  Ta13  1  0.002316  0.232963  0.351992  1
  Ta  Ta14  1  0.502316  0.275878  0.330663  1
  Ta  Ta15  1  0.502316  0.601549  0.388552  1
  Ta  Ta16  1  0.002316  0.336597  0.307083  1
  Ta  Ta17  1  0.752183  0.436387  0.355379  1
  Ta  Ta18  1  0.752169  0.936387  0.394959  1
  Ta  Ta19  1  0.002316  0.936387  0.303124  1
  Ta  Ta20  1  0.753868  0.120730  0.308475  1
  Ta  Ta21  1  0.252463  0.936387  0.394959  1
  Ta  Ta22  1  0.502316  0.102207  0.418788  1
  Ta  Ta23  1  0.250764  0.752043  0.308475  1
  Ta  Ta24  1  0.502316  0.770567  0.418788  1
  Ta  Ta25  1  0.502316  0.271225  0.388552  1
  Ta  Ta26  1  0.002316  0.535333  0.399866  1
  Ta  Ta27  1  0.502316  0.102694  0.361857  1
  Ta  Ta28  1  0.002316  0.138131  0.399853  1
  Ta  Ta29  1  0.502316  0.596895  0.330663  1
  Ta  Ta30  1  0.502316  0.436387  0.417916  1
  Ta  Ta31  1  0.502316  0.271328  0.505599  1
  Ta  Ta32  1  0.002316  0.836487  0.543234  1
  Ta  Ta33  1  0.251934  0.936387  0.499737  1
  Ta  Ta34  1  0.002316  0.139164  0.495013  1
  Ta  Ta35  1  0.002316  0.235406  0.543313  1
  Ta  Ta36  1  0.502316  0.436387  0.476289  1
  Ta  Ta37  1  0.252763  0.619009  0.447207  1
  Ta  Ta38  1  0.751870  0.253764  0.447207  1
  Ta  Ta39  1  0.002316  0.535431  0.494666  1
  Ta  Ta40  1  0.002316  0.337342  0.494666  1
  Ta  Ta41  1  0.002316  0.037831  0.447438  1
  Ta  Ta42  1  0.502316  0.936387  0.447320  1
  Ta  Ta43  1  0.002316  0.733609  0.495013  1
  Ta  Ta44  1  0.502316  0.770684  0.475800  1
  Ta  Ta45  1  0.502316  0.103086  0.532620  1
  Ta  Ta46  1  0.002316  0.834943  0.447438  1
  Ta  Ta47  1  0.752698  0.936387  0.499737  1
  Ta  Ta48  1  0.752869  0.436387  0.538625  1
  Ta  Ta49  1  0.002316  0.436387  0.447256  1
  Ta  Ta50  1  0.751870  0.619009  0.447207  1
  Ta  Ta51  1  0.251764  0.436387  0.538625  1
  Ta  Ta52  1  0.502316  0.600614  0.562615  1
  Ta  Ta53  1  0.252763  0.253764  0.447207  1
  Ta  Ta54  1  0.502316  0.272159  0.562615  1
  Ta  Ta55  1  0.502316  0.769687  0.532620  1
  Ta  Ta56  1  0.002316  0.036286  0.543234  1
  Ta  Ta57  1  0.502316  0.601445  0.505599  1
  Ta  Ta58  1  0.002316  0.637368  0.543313  1
  Ta  Ta59  1  0.502316  0.102090  0.475800  1
  Ta  Ta60  1  0.502316  0.936387  0.561181  1
  Ta  Ta61  1  0.502316  0.772954  0.648416  1
  Ta  Ta62  1  0.002316  0.338499  0.688865  1
  Ta  Ta63  1  0.250802  0.436387  0.644524  1
  Ta  Ta64  1  0.002316  0.637271  0.640273  1
  Ta  Ta65  1  0.002316  0.742375  0.686837  1
  Ta  Ta66  1  0.502316  0.936387  0.618210  1
  Ta  Ta67  1  0.252546  0.120591  0.590596  1
  Ta  Ta68  1  0.752086  0.752183  0.590596  1
  Ta  Ta69  1  0.002316  0.037439  0.637150  1
  Ta  Ta70  1  0.002316  0.835334  0.637150  1
  Ta  Ta71  1  0.002316  0.537922  0.591628  1
  Ta  Ta72  1  0.502316  0.436387  0.591562  1
  Ta  Ta73  1  0.002316  0.235503  0.640273  1
  Ta  Ta74  1  0.502316  0.271120  0.619946  1
  Ta  Ta75  1  0.502316  0.610396  0.676595  1
  Ta  Ta76  1  0.002316  0.334851  0.591628  1
  Ta  Ta77  1  0.753831  0.436387  0.644524  1
  Ta  Ta78  1  0.750227  0.936387  0.678571  1
  Ta  Ta79  1  0.002316  0.936387  0.590211  1
  Ta  Ta80  1  0.752086  0.120591  0.590596  1
  Ta  Ta81  1  0.254405  0.936387  0.678571  1
  Ta  Ta82  1  0.502316  0.088504  0.702753  1
  Ta  Ta83  1  0.252546  0.752183  0.590596  1
  Ta  Ta84  1  0.502316  0.784269  0.702753  1
  Ta  Ta85  1  0.502316  0.262377  0.676595  1
  Ta  Ta86  1  0.002316  0.534274  0.688865  1
  Ta  Ta87  1  0.502316  0.099820  0.648416  1
  Ta  Ta88  1  0.002316  0.130399  0.686837  1
  Ta  Ta89  1  0.502316  0.601654  0.619946  1
  Ta  Ta90  1  0.502316  0.436387  0.696906  1
