# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.66161968
_cell_length_b   35.18028629
_cell_length_c   50.16100019
_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   Ta198
_cell_volume   8226.25931519
_cell_formula_units_Z   198
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  0.012372  0.707534  0.361563  1
  Ta  Ta2  1  0.012372  0.080289  0.317299  1
  Ta  Ta3  1  1.012372  0.460741  0.277833  1
  Ta  Ta4  1  0.512372  0.521753  0.399633  1
  Ta  Ta5  1  0.512372  0.890425  0.328417  1
  Ta  Ta6  1  0.512372  0.271634  0.306726  1
  Ta  Ta7  1  0.012372  0.634860  0.387181  1
  Ta  Ta8  1  0.012372  1.004554  0.305456  1
  Ta  Ta9  1  1.012372  0.387832  0.301789  1
  Ta  Ta10  1  0.012372  0.540320  0.304372  1
  Ta  Ta11  1  0.012372  0.791684  0.393099  1
  Ta  Ta12  1  0.012372  0.162411  0.345156  1
  Ta  Ta13  1  0.512372  0.604095  0.429129  1
  Ta  Ta14  1  0.512372  0.966490  0.316153  1
  Ta  Ta15  1  0.512372  0.356592  0.336077  1
  Ta  Ta16  1  0.512372  0.582225  0.317711  1
  Ta  Ta17  1  0.512372  0.819673  0.352941  1
  Ta  Ta18  1  0.512372  0.188780  0.304213  1
  Ta  Ta19  1  1.012372  0.850426  0.263640  1
  Ta  Ta20  1  0.012372  0.090604  0.372552  1
  Ta  Ta21  1  1.012372  0.470180  0.329842  1
  Ta  Ta22  1  1.012372  0.699010  0.308071  1
  Ta  Ta23  1  0.012372  0.058367  0.264641  1
  Ta  Ta24  1  1.012372  0.327814  0.380481  1
  Ta  Ta25  1  0.512372  0.816839  0.296982  1
  Ta  Ta26  1  0.512372  0.064165  0.401443  1
  Ta  Ta27  1  0.512372  0.439797  0.369313  1
  Ta  Ta28  1  0.512372  0.657140  0.294704  1
  Ta  Ta29  1  0.512372  0.945112  0.368235  1
  Ta  Ta30  1  0.512372  0.284650  0.357787  1
  Ta  Ta31  1  0.012372  0.624689  0.329512  1
  Ta  Ta32  1  1.012372  0.871514  0.374706  1
  Ta  Ta33  1  1.012372  0.249292  0.376460  1
  Ta  Ta34  1  0.012372  0.553382  0.357990  1
  Ta  Ta35  1  1.012372  0.930530  0.285517  1
  Ta  Ta36  1  1.012372  0.177650  0.400571  1
  Ta  Ta37  1  0.512372  0.594311  0.372192  1
  Ta  Ta38  1  0.512372  0.984868  0.264661  1
  Ta  Ta39  1  0.512372  0.206340  0.357130  1
  Ta  Ta40  1  0.512372  0.511703  0.343778  1
  Ta  Ta41  1  0.512372  0.893904  0.276339  1
  Ta  Ta42  1  0.512372  0.137947  0.386384  1
  Ta  Ta43  1  1.012372  0.780257  0.337560  1
  Ta  Ta44  1  0.012372  0.147099  0.291566  1
  Ta  Ta45  1  1.012372  0.409224  0.411268  1
  Ta  Ta46  1  1.012372  0.774700  0.284999  1
  Ta  Ta47  1  0.012372  1.007872  0.367828  1
  Ta  Ta48  1  1.012372  0.398194  0.354342  1
  Ta  Ta49  1  0.512372  0.739990  0.319348  1
  Ta  Ta50  1  0.512372  0.114430  0.275164  1
  Ta  Ta51  1  0.512372  0.369613  0.394037  1
  Ta  Ta52  1  0.512372  0.676141  0.402671  1
  Ta  Ta53  1  0.512372  0.038882  0.348238  1
  Ta  Ta54  1  0.512372  0.430808  0.313222  1
  Ta  Ta55  1  0.012372  0.480919  0.385586  1
  Ta  Ta56  1  1.012372  0.854032  0.315627  1
  Ta  Ta57  1  0.012372  0.232804  0.321990  1
  Ta  Ta58  1  0.012372  0.562773  0.414908  1
  Ta  Ta59  1  0.012372  0.933265  0.338762  1
  Ta  Ta60  1  1.012372  0.312543  0.326873  1
  Ta  Ta61  1  0.512372  0.666509  0.346773  1
  Ta  Ta62  1  0.512372  0.046845  0.295162  1
  Ta  Ta63  1  0.512372  0.296918  0.411066  1
  Ta  Ta64  1  0.512372  0.748815  0.376862  1
  Ta  Ta65  1  0.512372  0.119449  0.331342  1
  Ta  Ta66  1  0.512372  0.502061  0.290697  1
  Ta  Ta67  1  1.012372  0.586980  0.526953  1
  Ta  Ta68  1  1.012372  0.953348  0.450963  1
  Ta  Ta69  1  0.012372  0.336799  0.436042  1
  Ta  Ta70  1  0.512372  0.392367  0.561937  1
  Ta  Ta71  1  0.512372  0.768383  0.489729  1
  Ta  Ta72  1  0.512372  0.144856  0.442463  1
  Ta  Ta73  1  0.012372  0.510275  0.533830  1
  Ta  Ta74  1  0.012372  0.873586  0.436711  1
  Ta  Ta75  1  1.012372  0.260572  0.431500  1
  Ta  Ta76  1  0.012372  0.417563  0.466367  1
  Ta  Ta77  1  1.012372  0.667195  0.557564  1
  Ta  Ta78  1  1.012372  0.043944  0.482223  1
  Ta  Ta79  1  0.512372  0.471469  0.546802  1
  Ta  Ta80  1  0.512372  0.840726  0.465709  1
  Ta  Ta81  1  0.512372  0.218612  0.417516  1
  Ta  Ta82  1  0.512372  0.450064  0.428247  1
  Ta  Ta83  1  0.512372  0.697081  0.516116  1
  Ta  Ta84  1  0.512372  0.069518  0.457176  1
  Ta  Ta85  1  0.012372  0.717078  0.418006  1
  Ta  Ta86  1  1.012372  0.968372  0.504705  1
  Ta  Ta87  1  1.012372  0.344239  0.490607  1
  Ta  Ta88  1  0.012372  0.569857  0.472716  1
  Ta  Ta89  1  0.012372  0.943414  0.398252  1
  Ta  Ta90  1  0.012372  0.191760  0.515545  1
  Ta  Ta91  1  0.512372  0.685627  0.459358  1
  Ta  Ta92  1  0.512372  0.936202  0.530278  1
  Ta  Ta93  1  0.512372  0.318222  0.518025  1
  Ta  Ta94  1  0.512372  0.533509  0.453770  1
  Ta  Ta95  1  0.512372  0.853991  0.521745  1
  Ta  Ta96  1  0.512372  0.196994  0.483906  1
  Ta  Ta97  1  0.012372  0.490846  0.442348  1
  Ta  Ta98  1  0.012372  0.738482  0.531284  1
  Ta  Ta99  1  1.012372  0.125979  0.484169  1
  Ta  Ta100  1  0.012372  0.430335  0.520272  1
  Ta  Ta101  1  0.012372  0.797305  0.448992  1
  Ta  Ta102  1  1.012372  0.054303  0.536349  1
  Ta  Ta103  1  0.512372  0.467406  0.486883  1
  Ta  Ta104  1  0.512372  0.830302  0.409944  1
  Ta  Ta105  1  0.512372  0.105371  0.508820  1
  Ta  Ta106  1  0.512372  0.394264  0.507232  1
  Ta  Ta107  1  0.512372  0.757826  0.433362  1
  Ta  Ta108  1  0.512372  0.018931  0.519292  1
  Ta  Ta109  1  1.012372  0.655845  0.500679  1
  Ta  Ta110  1  1.012372  0.026993  0.427167  1
  Ta  Ta111  1  1.012372  0.276574  0.546722  1
  Ta  Ta112  1  0.012372  0.644165  0.444373  1
  Ta  Ta113  1  1.012372  0.886674  0.496636  1
  Ta  Ta114  1  0.012372  0.263033  0.491247  1
  Ta  Ta115  1  0.512372  0.613837  0.485437  1
  Ta  Ta116  1  0.512372  0.988694  0.412275  1
  Ta  Ta117  1  0.512372  0.242634  0.529242  1
  Ta  Ta118  1  0.512372  0.552090  0.564306  1
  Ta  Ta119  1  0.512372  0.917653  0.475401  1
  Ta  Ta120  1  0.512372  0.286836  0.465260  1
  Ta  Ta121  1  1.012372  0.356182  0.546290  1
  Ta  Ta122  1  0.012372  0.726644  0.474624  1
  Ta  Ta123  1  1.012372  0.105998  0.428180  1
  Ta  Ta124  1  0.012372  0.440654  0.572340  1
  Ta  Ta125  1  0.012372  0.808537  0.503874  1
  Ta  Ta126  1  0.012372  0.191407  0.454614  1
  Ta  Ta127  1  0.512372  0.543321  0.509937  1
  Ta  Ta128  1  0.512372  0.909737  0.420220  1
  Ta  Ta129  1  0.512372  0.168967  0.543124  1
  Ta  Ta130  1  0.512372  0.625597  0.542189  1
  Ta  Ta131  1  0.512372  0.993301  0.466915  1
  Ta  Ta132  1  0.512372  0.373640  0.453173  1
  Ta  Ta133  1  1.012372  0.456098  0.685718  1
  Ta  Ta134  1  0.012372  0.836741  0.613960  1
  Ta  Ta135  1  1.012372  0.202572  0.570374  1
  Ta  Ta136  1  0.512372  0.267297  0.692668  1
  Ta  Ta137  1  0.512372  0.649448  0.655529  1
  Ta  Ta138  1  0.512372  0.016033  0.576540  1
  Ta  Ta139  1  1.012372  0.381367  0.667362  1
  Ta  Ta140  1  0.012372  0.751840  0.588271  1
  Ta  Ta141  1  0.012372  0.129063  0.552429  1
  Ta  Ta142  1  1.012372  0.289424  0.601284  1
  Ta  Ta143  1  1.012372  0.536118  0.708272  1
  Ta  Ta144  1  0.012372  0.920504  0.617721  1
  Ta  Ta145  1  0.512372  0.338063  0.677647  1
  Ta  Ta146  1  0.512372  0.722619  0.627897  1
  Ta  Ta147  1  0.512372  0.089418  0.562586  1
  Ta  Ta148  1  0.512372  0.314991  0.574580  1
  Ta  Ta149  1  0.512372  0.570373  0.675852  1
  Ta  Ta150  1  0.512372  0.939935  0.584284  1
  Ta  Ta151  1  1.012372  0.593191  0.582215  1
  Ta  Ta152  1  0.012372  0.871528  0.663128  1
  Ta  Ta153  1  1.012372  0.213347  0.624646  1
  Ta  Ta154  1  0.012372  0.452023  0.632440  1
  Ta  Ta155  1  0.012372  0.820873  0.558526  1
  Ta  Ta156  1  1.012372  0.063503  0.654944  1
  Ta  Ta157  1  0.512372  0.566643  0.620357  1
  Ta  Ta158  1  0.512372  0.815596  0.656321  1
  Ta  Ta159  1  0.512372  0.191503  0.651604  1
  Ta  Ta160  1  0.512372  0.442092  0.602573  1
  Ta  Ta161  1  0.512372  0.737057  0.678752  1
  Ta  Ta162  1  0.512372  0.062964  0.620592  1
  Ta  Ta163  1  1.012372  0.377437  0.604848  1
  Ta  Ta164  1  1.012372  0.613046  0.689258  1
  Ta  Ta165  1  1.012372  1.002603  0.617945  1
  Ta  Ta166  1  1.012372  0.306265  0.654113  1
  Ta  Ta167  1  1.012372  0.680248  0.613636  1
  Ta  Ta168  1  1.012372  0.965936  0.666108  1
  Ta  Ta169  1  0.512372  0.349030  0.624934  1
  Ta  Ta170  1  0.512372  0.709410  0.572700  1
  Ta  Ta171  1  0.512372  0.968379  0.631825  1
  Ta  Ta172  1  0.512372  0.268929  0.637818  1
  Ta  Ta173  1  0.512372  0.637694  0.598288  1
  Ta  Ta174  1  0.512372  0.920153  0.672597  1
  Ta  Ta175  1  1.012372  0.532905  0.656213  1
  Ta  Ta176  1  1.012372  0.900163  0.554034  1
  Ta  Ta177  1  1.012372  0.155190  0.673479  1
  Ta  Ta178  1  1.012372  0.512601  0.596747  1
  Ta  Ta179  1  0.012372  0.768342  0.644984  1
  Ta  Ta180  1  1.012372  0.131774  0.623109  1
  Ta  Ta181  1  0.512372  0.495521  0.643089  1
  Ta  Ta182  1  0.512372  0.863426  0.576382  1
  Ta  Ta183  1  0.512372  0.112698  0.659820  1
  Ta  Ta184  1  0.512372  0.401438  0.706831  1
  Ta  Ta185  1  0.512372  0.793899  0.603199  1
  Ta  Ta186  1  0.512372  0.151216  0.598419  1
  Ta  Ta187  1  0.012372  0.237647  0.675750  1
  Ta  Ta188  1  1.012372  0.608450  0.637154  1
  Ta  Ta189  1  1.012372  0.979999  0.559903  1
  Ta  Ta190  1  1.012372  0.324434  0.706712  1
  Ta  Ta191  1  1.012372  0.691874  0.666620  1
  Ta  Ta192  1  0.012372  0.069516  0.590895  1
  Ta  Ta193  1  0.512372  0.419490  0.655244  1
  Ta  Ta194  1  0.512372  0.780433  0.545938  1
  Ta  Ta195  1  0.512372  0.020326  0.667823  1
  Ta  Ta196  1  0.512372  0.492632  0.695279  1
  Ta  Ta197  1  0.512372  0.880694  0.628398  1
  Ta  Ta198  1  0.512372  0.236277  0.587663  1
