# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.11136931
_cell_length_b   14.58794260
_cell_length_c   51.48963656
_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   Ta180
_cell_volume   7594.93121713
_cell_formula_units_Z   180
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  0.966232  0.874234  0.411370  1
  Ta  Ta2  1  0.970932  0.614621  0.340550  1
  Ta  Ta3  1  0.259690  0.026085  0.295475  1
  Ta  Ta4  1  0.261154  0.277122  0.366970  1
  Ta  Ta5  1  0.315737  0.089400  0.384654  1
  Ta  Ta6  1  0.324917  0.829401  0.312166  1
  Ta  Ta7  1  0.134824  0.793815  0.360990  1
  Ta  Ta8  1  0.124362  0.533553  0.295637  1
  Ta  Ta9  1  0.871036  0.823290  0.350967  1
  Ta  Ta10  1  0.870163  0.084493  0.423380  1
  Ta  Ta11  1  0.900936  0.229961  0.310339  1
  Ta  Ta12  1  0.899163  0.487608  0.377793  1
  Ta  Ta13  1  0.820223  0.152137  0.365441  1
  Ta  Ta14  1  0.810360  0.883821  0.296299  1
  Ta  Ta15  1  0.187128  0.721053  0.419436  1
  Ta  Ta16  1  0.184449  0.458488  0.347115  1
  Ta  Ta17  1  0.740430  0.600103  0.418468  1
  Ta  Ta18  1  0.739875  0.339246  0.348492  1
  Ta  Ta19  1  0.938943  0.693988  0.390510  1
  Ta  Ta20  1  0.931956  0.431248  0.316232  1
  Ta  Ta21  1  0.401955  0.758206  0.370470  1
  Ta  Ta22  1  0.397141  0.491841  0.304087  1
  Ta  Ta23  1  0.501145  0.936113  0.392860  1
  Ta  Ta24  1  0.509395  0.681599  0.318235  1
  Ta  Ta25  1  0.530846  0.995786  0.306683  1
  Ta  Ta26  1  0.537401  0.244367  0.377017  1
  Ta  Ta27  1  0.566349  0.062219  0.356620  1
  Ta  Ta28  1  0.565674  0.324991  0.427214  1
  Ta  Ta29  1  0.037132  0.999275  0.373740  1
  Ta  Ta30  1  0.044047  0.751204  0.304714  1
  Ta  Ta31  1  0.603761  0.858434  0.342296  1
  Ta  Ta32  1  0.604028  0.116053  0.414284  1
  Ta  Ta33  1  0.316320  0.959395  0.347489  1
  Ta  Ta34  1  0.317587  0.220386  0.420271  1
  Ta  Ta35  1  0.685020  0.782516  0.400421  1
  Ta  Ta36  1  0.680941  0.516042  0.329397  1
  Ta  Ta37  1  0.984620  0.061195  0.286928  1
  Ta  Ta38  1  0.002185  0.311468  0.356912  1
  Ta  Ta39  1  0.813006  0.022848  0.328573  1
  Ta  Ta40  1  0.816890  0.284429  0.401295  1
  Ta  Ta41  1  0.668676  0.366913  0.294907  1
  Ta  Ta42  1  0.689324  0.655138  0.363389  1
  Ta  Ta43  1  0.432580  0.292678  0.287869  1
  Ta  Ta44  1  0.439395  0.554880  0.357957  1
  Ta  Ta45  1  0.185335  0.317791  0.312233  1
  Ta  Ta46  1  0.187106  0.589091  0.383332  1
  Ta  Ta47  1  0.764418  0.966985  0.383224  1
  Ta  Ta48  1  0.771602  0.702369  0.310214  1
  Ta  Ta49  1  0.371012  0.161903  0.328968  1
  Ta  Ta50  1  0.369904  0.422630  0.397551  1
  Ta  Ta51  1  0.065257  0.929727  0.321141  1
  Ta  Ta52  1  0.065082  0.183005  0.394662  1
  Ta  Ta53  1  0.634026  0.190108  0.318719  1
  Ta  Ta54  1  0.632172  0.455588  0.387641  1
  Ta  Ta55  1  0.466071  0.631725  0.409196  1
  Ta  Ta56  1  0.463505  0.365952  0.338799  1
  Ta  Ta57  1  0.239882  0.905748  0.401769  1
  Ta  Ta58  1  0.246526  0.649494  0.329732  1
  Ta  Ta59  1  0.100808  0.128487  0.337269  1
  Ta  Ta60  1  0.103802  0.389510  0.407331  1
  Ta  Ta61  1  0.966027  0.397285  0.554661  1
  Ta  Ta62  1  0.965764  0.135563  0.483184  1
  Ta  Ta63  1  0.263801  0.537607  0.437568  1
  Ta  Ta64  1  0.263741  0.798574  0.509496  1
  Ta  Ta65  1  0.318122  0.614415  0.527683  1
  Ta  Ta66  1  0.317074  0.352494  0.456037  1
  Ta  Ta67  1  0.133539  0.312801  0.505240  1
  Ta  Ta68  1  0.133593  0.051000  0.433531  1
  Ta  Ta69  1  0.870318  0.346304  0.495053  1
  Ta  Ta70  1  0.870195  0.608223  0.566796  1
  Ta  Ta71  1  0.900167  0.747666  0.449563  1
  Ta  Ta72  1  0.899968  0.008805  0.521552  1
  Ta  Ta73  1  0.818403  0.676444  0.508606  1
  Ta  Ta74  1  0.817979  0.415538  0.436745  1
  Ta  Ta75  1  0.185901  0.243725  0.563585  1
  Ta  Ta76  1  0.185504  0.982562  0.491685  1
  Ta  Ta77  1  0.740264  0.121206  0.562654  1
  Ta  Ta78  1  0.740157  0.860390  0.490796  1
  Ta  Ta79  1  0.938149  0.214734  0.534272  1
  Ta  Ta80  1  0.937587  0.953728  0.462446  1
  Ta  Ta81  1  0.399949  0.280290  0.514799  1
  Ta  Ta82  1  0.399565  0.018655  0.443181  1
  Ta  Ta83  1  0.501984  0.460332  0.535833  1
  Ta  Ta84  1  0.501733  0.198733  0.464434  1
  Ta  Ta85  1  0.538224  0.506929  0.447262  1
  Ta  Ta86  1  0.537773  0.766934  0.518973  1
  Ta  Ta87  1  0.566435  0.585288  0.498366  1
  Ta  Ta88  1  0.566414  0.846634  0.569927  1
  Ta  Ta89  1  0.038040  0.523635  0.517115  1
  Ta  Ta90  1  0.037851  0.261928  0.445595  1
  Ta  Ta91  1  0.603845  0.378803  0.485466  1
  Ta  Ta92  1  0.604186  0.640284  0.557062  1
  Ta  Ta93  1  0.317365  0.482896  0.491673  1
  Ta  Ta94  1  0.316708  0.744617  0.563628  1
  Ta  Ta95  1  0.686583  0.306487  0.544200  1
  Ta  Ta96  1  0.685738  0.044663  0.472572  1
  Ta  Ta97  1  0.002275  0.568868  0.428128  1
  Ta  Ta98  1  0.001980  0.829478  0.500136  1
  Ta  Ta99  1  0.816988  0.547522  0.472442  1
  Ta  Ta100  1  0.817841  0.808545  0.544538  1
  Ta  Ta101  1  0.686804  0.914026  0.436753  1
  Ta  Ta102  1  0.686554  0.176113  0.508581  1
  Ta  Ta103  1  0.437472  0.812238  0.430328  1
  Ta  Ta104  1  0.437409  0.073733  0.501894  1
  Ta  Ta105  1  0.186022  0.850391  0.455733  1
  Ta  Ta106  1  0.186950  0.111688  0.527834  1
  Ta  Ta107  1  0.764083  0.491533  0.526460  1
  Ta  Ta108  1  0.763677  0.229839  0.455052  1
  Ta  Ta109  1  0.370286  0.681948  0.469360  1
  Ta  Ta110  1  0.369808  0.943474  0.541205  1
  Ta  Ta111  1  0.065783  0.444344  0.466032  1
  Ta  Ta112  1  0.066285  0.705306  0.537860  1
  Ta  Ta113  1  0.634077  0.715489  0.459050  1
  Ta  Ta114  1  0.633595  0.977000  0.530887  1
  Ta  Ta115  1  0.465711  0.152199  0.552981  1
  Ta  Ta116  1  0.466031  0.892037  0.481288  1
  Ta  Ta117  1  0.240054  0.429440  0.545232  1
  Ta  Ta118  1  0.239702  0.167549  0.473807  1
  Ta  Ta119  1  0.104018  0.650165  0.478704  1
  Ta  Ta120  1  0.103770  0.911116  0.550737  1
  Ta  Ta121  1  0.962148  0.906517  0.695312  1
  Ta  Ta122  1  0.966080  0.660346  0.627065  1
  Ta  Ta123  1  0.263550  0.058871  0.581761  1
  Ta  Ta124  1  0.264046  0.320313  0.651622  1
  Ta  Ta125  1  0.324205  0.143826  0.670528  1
  Ta  Ta126  1  0.319031  0.876407  0.599817  1
  Ta  Ta127  1  0.132701  0.835284  0.649502  1
  Ta  Ta128  1  0.133543  0.574910  0.577045  1
  Ta  Ta129  1  0.870261  0.863217  0.639701  1
  Ta  Ta130  1  0.880127  0.124904  0.704515  1
  Ta  Ta131  1  0.900002  0.269387  0.592774  1
  Ta  Ta132  1  0.901533  0.529014  0.662549  1
  Ta  Ta133  1  0.819779  0.200381  0.653075  1
  Ta  Ta134  1  0.817260  0.937713  0.580829  1
  Ta  Ta135  1  0.210087  0.782025  0.702363  1
  Ta  Ta136  1  0.182412  0.507840  0.635116  1
  Ta  Ta137  1  0.740572  0.635054  0.704018  1
  Ta  Ta138  1  0.742142  0.381609  0.633151  1
  Ta  Ta139  1  0.941041  0.725421  0.680655  1
  Ta  Ta140  1  0.938391  0.476401  0.605504  1
  Ta  Ta141  1  0.401825  0.801742  0.657510  1
  Ta  Ta142  1  0.399440  0.543075  0.586029  1
  Ta  Ta143  1  0.496263  0.977485  0.681840  1
  Ta  Ta144  1  0.502693  0.722565  0.607359  1
  Ta  Ta145  1  0.537915  0.027256  0.590991  1
  Ta  Ta146  1  0.540327  0.293170  0.661419  1
  Ta  Ta147  1  0.565470  0.104060  0.642192  1
  Ta  Ta148  1  0.571304  0.366242  0.712345  1
  Ta  Ta149  1  0.033215  0.044573  0.659587  1
  Ta  Ta150  1  0.037809  0.784316  0.589023  1
  Ta  Ta151  1  0.603721  0.900825  0.629601  1
  Ta  Ta152  1  0.607342  0.167092  0.696050  1
  Ta  Ta153  1  0.315370  0.004068  0.636752  1
  Ta  Ta154  1  0.335213  0.292007  0.705272  1
  Ta  Ta155  1  0.681502  0.829411  0.688113  1
  Ta  Ta156  1  0.686915  0.569414  0.615611  1
  Ta  Ta157  1  1.001875  0.089910  0.572110  1
  Ta  Ta158  1  1.001378  0.347020  0.642990  1
  Ta  Ta159  1  0.817540  0.069728  0.616877  1
  Ta  Ta160  1  0.818485  0.341070  0.687888  1
  Ta  Ta161  1  0.686182  0.438693  0.579931  1
  Ta  Ta162  1  0.688595  0.699643  0.652655  1
  Ta  Ta163  1  0.438003  0.334220  0.573078  1
  Ta  Ta164  1  0.436259  0.597386  0.643887  1
  Ta  Ta165  1  0.186961  0.375528  0.598958  1
  Ta  Ta166  1  0.188583  0.635965  0.672460  1
  Ta  Ta167  1  0.758786  0.009177  0.670475  1
  Ta  Ta168  1  0.764125  0.753218  0.598504  1
  Ta  Ta169  1  0.371970  0.203492  0.612589  1
  Ta  Ta170  1  0.368301  0.469327  0.681775  1
  Ta  Ta171  1  0.065094  0.964524  0.609806  1
  Ta  Ta172  1  0.072309  0.228074  0.683906  1
  Ta  Ta173  1  0.633990  0.236369  0.602611  1
  Ta  Ta174  1  0.631759  0.497082  0.671278  1
  Ta  Ta175  1  0.471107  0.664531  0.693576  1
  Ta  Ta176  1  0.466195  0.415227  0.623298  1
  Ta  Ta177  1  0.233138  0.960153  0.690196  1
  Ta  Ta178  1  0.238947  0.692097  0.617405  1
  Ta  Ta179  1  0.105110  0.171384  0.622353  1
  Ta  Ta180  1  0.103181  0.426641  0.688927  1
