# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.10594340
_cell_length_b   10.10594340
_cell_length_c   48.04117619
_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   Ta120
_cell_volume   4906.44974852
_cell_formula_units_Z   120
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  0.634919  0.965045  0.354800  1
  Ta  Ta2  1  0.068945  0.267422  0.300103  1
  Ta  Ta3  1  0.316041  0.316041  0.381220  1
  Ta  Ta4  1  0.538797  0.133147  0.303983  1
  Ta  Ta5  1  0.465284  0.870934  0.303983  1
  Ta  Ta6  1  0.900974  0.900974  0.352407  1
  Ta  Ta7  1  0.182115  0.821966  0.380664  1
  Ta  Ta8  1  0.817683  0.186398  0.323050  1
  Ta  Ta9  1  0.935136  0.736659  0.300103  1
  Ta  Ta10  1  0.736659  0.935136  0.300103  1
  Ta  Ta11  1  0.601933  0.402148  0.307200  1
  Ta  Ta12  1  0.502040  0.502040  0.358117  1
  Ta  Ta13  1  0.133147  0.538797  0.303983  1
  Ta  Ta14  1  0.237332  0.568344  0.356623  1
  Ta  Ta15  1  0.369162  0.039036  0.354800  1
  Ta  Ta16  1  0.402148  0.601933  0.307200  1
  Ta  Ta17  1  0.321197  0.321197  0.323427  1
  Ta  Ta18  1  0.682884  0.682884  0.323427  1
  Ta  Ta19  1  0.002040  0.002040  0.299541  1
  Ta  Ta20  1  0.186398  0.817683  0.323050  1
  Ta  Ta21  1  0.688040  0.688040  0.381220  1
  Ta  Ta22  1  0.766749  0.435737  0.356623  1
  Ta  Ta23  1  0.821966  0.182115  0.380664  1
  Ta  Ta24  1  0.435737  0.766749  0.356623  1
  Ta  Ta25  1  0.039036  0.369162  0.354800  1
  Ta  Ta26  1  0.267422  0.068945  0.300103  1
  Ta  Ta27  1  0.965045  0.634919  0.354800  1
  Ta  Ta28  1  0.870934  0.465284  0.303983  1
  Ta  Ta29  1  0.568344  0.237332  0.356623  1
  Ta  Ta30  1  0.103107  0.103107  0.352407  1
  Ta  Ta31  1  0.634225  0.965363  0.466235  1
  Ta  Ta32  1  0.067512  0.266154  0.410141  1
  Ta  Ta33  1  0.318639  0.318639  0.493917  1
  Ta  Ta34  1  0.538536  0.133392  0.410981  1
  Ta  Ta35  1  0.465545  0.870689  0.410981  1
  Ta  Ta36  1  0.901193  0.901193  0.465652  1
  Ta  Ta37  1  0.184676  0.819404  0.493586  1
  Ta  Ta38  1  0.818959  0.185122  0.437462  1
  Ta  Ta39  1  0.936569  0.737927  0.410141  1
  Ta  Ta40  1  0.737927  0.936569  0.410141  1
  Ta  Ta41  1  0.603726  0.400355  0.411150  1
  Ta  Ta42  1  0.502040  0.502040  0.466470  1
  Ta  Ta43  1  0.133392  0.538536  0.410981  1
  Ta  Ta44  1  0.237349  0.567868  0.466445  1
  Ta  Ta45  1  0.369856  0.038718  0.466235  1
  Ta  Ta46  1  0.400355  0.603726  0.411150  1
  Ta  Ta47  1  0.319201  0.319201  0.437664  1
  Ta  Ta48  1  0.684880  0.684880  0.437664  1
  Ta  Ta49  1  0.002040  0.002040  0.409183  1
  Ta  Ta50  1  0.185122  0.818959  0.437462  1
  Ta  Ta51  1  0.685442  0.685442  0.493917  1
  Ta  Ta52  1  0.766732  0.436213  0.466445  1
  Ta  Ta53  1  0.819404  0.184676  0.493586  1
  Ta  Ta54  1  0.436213  0.766732  0.466445  1
  Ta  Ta55  1  0.038718  0.369856  0.466235  1
  Ta  Ta56  1  0.266154  0.067512  0.410141  1
  Ta  Ta57  1  0.965363  0.634225  0.466235  1
  Ta  Ta58  1  0.870689  0.465545  0.410981  1
  Ta  Ta59  1  0.567868  0.237349  0.466445  1
  Ta  Ta60  1  0.102888  0.102888  0.465652  1
  Ta  Ta61  1  0.633593  0.965606  0.577803  1
  Ta  Ta62  1  0.067780  0.266687  0.521905  1
  Ta  Ta63  1  0.319670  0.319670  0.605956  1
  Ta  Ta64  1  0.538632  0.134073  0.522145  1
  Ta  Ta65  1  0.465449  0.870008  0.522145  1
  Ta  Ta66  1  0.900803  0.900803  0.577291  1
  Ta  Ta67  1  0.185494  0.818587  0.605430  1
  Ta  Ta68  1  0.818498  0.185583  0.549661  1
  Ta  Ta69  1  0.936301  0.737394  0.521905  1
  Ta  Ta70  1  0.737394  0.936301  0.521905  1
  Ta  Ta71  1  0.602965  0.401116  0.522183  1
  Ta  Ta72  1  0.502040  0.502040  0.578454  1
  Ta  Ta73  1  0.134073  0.538632  0.522145  1
  Ta  Ta74  1  0.237611  0.567563  0.578246  1
  Ta  Ta75  1  0.370487  0.038475  0.577803  1
  Ta  Ta76  1  0.401116  0.602965  0.522183  1
  Ta  Ta77  1  0.319374  0.319374  0.549868  1
  Ta  Ta78  1  0.684707  0.684707  0.549868  1
  Ta  Ta79  1  0.002040  0.002040  0.521513  1
  Ta  Ta80  1  0.185583  0.818498  0.549661  1
  Ta  Ta81  1  0.684411  0.684411  0.605956  1
  Ta  Ta82  1  0.766470  0.436517  0.578246  1
  Ta  Ta83  1  0.818587  0.185494  0.605430  1
  Ta  Ta84  1  0.436517  0.766470  0.578246  1
  Ta  Ta85  1  0.038475  0.370487  0.577803  1
  Ta  Ta86  1  0.266687  0.067780  0.521905  1
  Ta  Ta87  1  0.965606  0.633593  0.577803  1
  Ta  Ta88  1  0.870008  0.465449  0.522145  1
  Ta  Ta89  1  0.567563  0.237611  0.578246  1
  Ta  Ta90  1  0.103278  0.103278  0.577291  1
  Ta  Ta91  1  0.637942  0.964556  0.687712  1
  Ta  Ta92  1  0.068325  0.266814  0.632955  1
  Ta  Ta93  1  0.292910  0.292910  0.714683  1
  Ta  Ta94  1  0.538623  0.134738  0.634331  1
  Ta  Ta95  1  0.465458  0.869343  0.634331  1
  Ta  Ta96  1  0.903100  0.903100  0.686177  1
  Ta  Ta97  1  0.158642  0.845439  0.713865  1
  Ta  Ta98  1  0.813340  0.190741  0.661261  1
  Ta  Ta99  1  0.935756  0.737267  0.632955  1
  Ta  Ta100  1  0.737267  0.935756  0.632955  1
  Ta  Ta101  1  0.602578  0.401503  0.635254  1
  Ta  Ta102  1  0.502040  0.502040  0.692281  1
  Ta  Ta103  1  0.134738  0.538623  0.634331  1
  Ta  Ta104  1  0.235186  0.568588  0.692092  1
  Ta  Ta105  1  0.366138  0.039524  0.687712  1
  Ta  Ta106  1  0.401503  0.602578  0.635254  1
  Ta  Ta107  1  0.323833  0.323833  0.661868  1
  Ta  Ta108  1  0.680248  0.680248  0.661868  1
  Ta  Ta109  1  0.002040  0.002040  0.632355  1
  Ta  Ta110  1  0.190741  0.813340  0.661261  1
  Ta  Ta111  1  0.711171  0.711171  0.714683  1
  Ta  Ta112  1  0.768895  0.435493  0.692092  1
  Ta  Ta113  1  0.845439  0.158642  0.713865  1
  Ta  Ta114  1  0.435493  0.768895  0.692092  1
  Ta  Ta115  1  0.039524  0.366138  0.687712  1
  Ta  Ta116  1  0.266814  0.068325  0.632955  1
  Ta  Ta117  1  0.964556  0.637942  0.687712  1
  Ta  Ta118  1  0.869343  0.465458  0.634331  1
  Ta  Ta119  1  0.568588  0.235186  0.692092  1
  Ta  Ta120  1  0.100981  0.100981  0.686177  1
