# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.66050745
_cell_length_b   7.33910396
_cell_length_c   48.40270408
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   108.43494882
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta40
_cell_volume   1570.60554198
_cell_formula_units_Z   40
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  0.215630  0.552510  0.291051  1
  Ta  Ta2  1  0.432974  0.987817  0.312089  1
  Ta  Ta3  1  0.609537  0.339657  0.282820  1
  Ta  Ta4  1  0.820604  0.762896  0.301705  1
  Ta  Ta5  1  0.656510  0.434879  0.336057  1
  Ta  Ta6  1  0.879698  0.881503  0.357398  1
  Ta  Ta7  1  0.044686  0.211336  0.321719  1
  Ta  Ta8  1  0.267858  0.657739  0.346479  1
  Ta  Ta9  1  0.100018  0.322283  0.380190  1
  Ta  Ta10  1  0.322979  0.768302  0.403369  1
  Ta  Ta11  1  0.489104  0.100418  0.368736  1
  Ta  Ta12  1  0.712206  0.546669  0.392269  1
  Ta  Ta13  1  0.544665  0.211819  0.426025  1
  Ta  Ta14  1  0.766987  0.656570  0.449091  1
  Ta  Ta15  1  0.933853  0.990125  0.414677  1
  Ta  Ta16  1  0.155726  0.433994  0.437493  1
  Ta  Ta17  1  0.988957  0.100639  0.471796  1
  Ta  Ta18  1  0.210927  0.544696  0.494607  1
  Ta  Ta19  1  0.377993  0.878648  0.460416  1
  Ta  Ta20  1  0.599883  0.322550  0.483190  1
  Ta  Ta21  1  0.433128  0.989216  0.517521  1
  Ta  Ta22  1  0.655019  0.433119  0.540295  1
  Ta  Ta23  1  0.822084  0.767070  0.506104  1
  Ta  Ta24  1  0.044054  0.211127  0.528915  1
  Ta  Ta25  1  0.877285  0.877773  0.563218  1
  Ta  Ta26  1  0.099158  0.321641  0.586035  1
  Ta  Ta27  1  0.266024  0.655197  0.551620  1
  Ta  Ta28  1  0.488346  0.099947  0.574686  1
  Ta  Ta29  1  0.320805  0.765097  0.608442  1
  Ta  Ta30  1  0.543907  0.211349  0.631975  1
  Ta  Ta31  1  0.710033  0.543465  0.597342  1
  Ta  Ta32  1  0.932994  0.989483  0.620521  1
  Ta  Ta33  1  0.765154  0.654027  0.654232  1
  Ta  Ta34  1  0.988325  0.100430  0.678993  1
  Ta  Ta35  1  0.153313  0.430263  0.643313  1
  Ta  Ta36  1  0.376501  0.876887  0.664654  1
  Ta  Ta37  1  0.212407  0.548870  0.699006  1
  Ta  Ta38  1  0.423474  0.972109  0.717891  1
  Ta  Ta39  1  0.600037  0.323949  0.688622  1
  Ta  Ta40  1  0.817381  0.759256  0.709660  1
