# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.33573448
_cell_length_b   22.63958527
_cell_length_c   54.39597948
_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   6570.96990333
_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  0.501919  0.640242  0.316583  1
  Ta  Ta2  1  0.501919  0.040461  0.399633  1
  Ta  Ta3  1  0.001919  0.003741  0.304323  1
  Ta  Ta4  1  0.001919  0.406620  0.384859  1
  Ta  Ta5  1  0.255600  0.031019  0.261020  1
  Ta  Ta6  1  0.251249  0.434831  0.338048  1
  Ta  Ta7  1  0.001919  0.953870  0.401538  1
  Ta  Ta8  1  0.001919  0.554641  0.318240  1
  Ta  Ta9  1  0.001919  0.645319  0.352170  1
  Ta  Ta10  1  0.001919  0.237288  0.272305  1
  Ta  Ta11  1  0.501919  0.716858  0.277335  1
  Ta  Ta12  1  0.501919  0.119769  0.360378  1
  Ta  Ta13  1  0.252271  0.609143  0.403068  1
  Ta  Ta14  1  0.252794  0.208721  0.318765  1
  Ta  Ta15  1  0.751136  0.988887  0.350784  1
  Ta  Ta16  1  0.752372  0.591192  0.270408  1
  Ta  Ta17  1  0.001919  0.791555  0.281171  1
  Ta  Ta18  1  0.001919  0.192275  0.367786  1
  Ta  Ta19  1  0.001919  0.675985  0.301210  1
  Ta  Ta20  1  0.001919  0.072957  0.384602  1
  Ta  Ta21  1  0.001919  0.860245  0.368022  1
  Ta  Ta22  1  0.001919  0.464863  0.284046  1
  Ta  Ta23  1  0.501919  0.799627  0.376412  1
  Ta  Ta24  1  0.501919  0.398987  0.290032  1
  Ta  Ta25  1  0.001919  0.915616  0.269182  1
  Ta  Ta26  1  0.001919  0.310923  0.351028  1
  Ta  Ta27  1  0.501919  0.720408  0.415276  1
  Ta  Ta28  1  0.501919  0.320821  0.329724  1
  Ta  Ta29  1  0.501919  0.157553  0.271514  1
  Ta  Ta30  1  0.501919  0.558380  0.354203  1
  Ta  Ta31  1  0.001919  0.739129  0.384993  1
  Ta  Ta32  1  0.001919  0.337963  0.301475  1
  Ta  Ta33  1  0.748238  0.031019  0.261020  1
  Ta  Ta34  1  0.752589  0.434831  0.338048  1
  Ta  Ta35  1  0.752220  0.764076  0.330069  1
  Ta  Ta36  1  0.752273  0.163178  0.414186  1
  Ta  Ta37  1  0.001919  0.099967  0.334989  1
  Ta  Ta38  1  0.001919  0.691835  0.252488  1
  Ta  Ta39  1  0.751566  0.609143  0.403068  1
  Ta  Ta40  1  0.751044  0.208721  0.318765  1
  Ta  Ta41  1  0.251617  0.764076  0.330069  1
  Ta  Ta42  1  0.251565  0.163178  0.414186  1
  Ta  Ta43  1  0.501919  0.879028  0.337736  1
  Ta  Ta44  1  0.501919  0.488095  0.256877  1
  Ta  Ta45  1  0.252701  0.988887  0.350784  1
  Ta  Ta46  1  0.251465  0.591192  0.270408  1
  Ta  Ta47  1  0.501919  0.681064  0.365600  1
  Ta  Ta48  1  0.501919  0.278228  0.280709  1
  Ta  Ta49  1  0.501919  0.956873  0.297359  1
  Ta  Ta50  1  0.501919  0.359133  0.380573  1
  Ta  Ta51  1  0.001919  0.122379  0.284823  1
  Ta  Ta52  1  0.001919  0.525351  0.368600  1
  Ta  Ta53  1  0.501919  0.838562  0.288290  1
  Ta  Ta54  1  0.501919  0.239995  0.370873  1
  Ta  Ta55  1  0.001919  0.883529  0.317272  1
  Ta  Ta56  1  0.001919  0.287807  0.401274  1
  Ta  Ta57  1  0.501919  0.918016  0.388001  1
  Ta  Ta58  1  0.501919  0.515926  0.305063  1
  Ta  Ta59  1  0.501919  0.077855  0.310244  1
  Ta  Ta60  1  0.501919  0.478407  0.392736  1
  Ta  Ta61  1  0.501919  0.440474  0.483033  1
  Ta  Ta62  1  0.501919  0.840414  0.566396  1
  Ta  Ta63  1  0.001919  0.806723  0.468894  1
  Ta  Ta64  1  0.001919  0.207256  0.552531  1
  Ta  Ta65  1  0.251491  0.835954  0.422538  1
  Ta  Ta66  1  0.251528  0.236509  0.506056  1
  Ta  Ta67  1  0.001919  0.753944  0.568343  1
  Ta  Ta68  1  0.001919  0.353943  0.484908  1
  Ta  Ta69  1  0.001919  0.444975  0.519020  1
  Ta  Ta70  1  0.001919  0.045114  0.435546  1
  Ta  Ta71  1  0.501919  0.519359  0.443639  1
  Ta  Ta72  1  0.501919  0.919875  0.527297  1
  Ta  Ta73  1  0.252322  0.409466  0.570540  1
  Ta  Ta74  1  0.252303  0.009572  0.486704  1
  Ta  Ta75  1  0.751534  0.789467  0.517204  1
  Ta  Ta76  1  0.751500  0.389479  0.433362  1
  Ta  Ta77  1  0.001919  0.591699  0.451418  1
  Ta  Ta78  1  0.001919  0.992316  0.535015  1
  Ta  Ta79  1  0.001919  0.472469  0.467901  1
  Ta  Ta80  1  0.001919  0.872962  0.551522  1
  Ta  Ta81  1  0.001919  0.659893  0.535251  1
  Ta  Ta82  1  0.001919  0.260497  0.451476  1
  Ta  Ta83  1  0.501919  0.599046  0.543860  1
  Ta  Ta84  1  0.501919  0.199954  0.460035  1
  Ta  Ta85  1  0.001919  0.711074  0.435076  1
  Ta  Ta86  1  0.001919  0.111666  0.518737  1
  Ta  Ta87  1  0.501919  0.520244  0.582902  1
  Ta  Ta88  1  0.501919  0.120829  0.498861  1
  Ta  Ta89  1  0.501919  0.958644  0.437507  1
  Ta  Ta90  1  0.501919  0.358457  0.520887  1
  Ta  Ta91  1  0.001919  0.538482  0.552420  1
  Ta  Ta92  1  0.001919  0.139122  0.468655  1
  Ta  Ta93  1  0.752346  0.835954  0.422538  1
  Ta  Ta94  1  0.752309  0.236509  0.506056  1
  Ta  Ta95  1  0.752303  0.562469  0.497863  1
  Ta  Ta96  1  0.752356  0.963134  0.581382  1
  Ta  Ta97  1  0.001919  0.899519  0.501954  1
  Ta  Ta98  1  0.001919  0.499131  0.418219  1
  Ta  Ta99  1  0.751515  0.409466  0.570540  1
  Ta  Ta100  1  0.751534  0.009572  0.486704  1
  Ta  Ta101  1  0.251534  0.562469  0.497863  1
  Ta  Ta102  1  0.251482  0.963134  0.581382  1
  Ta  Ta103  1  0.501919  0.678195  0.505048  1
  Ta  Ta104  1  0.501919  0.278743  0.420982  1
  Ta  Ta105  1  0.252304  0.789467  0.517204  1
  Ta  Ta106  1  0.252338  0.389479  0.433362  1
  Ta  Ta107  1  0.501919  0.480237  0.532879  1
  Ta  Ta108  1  0.501919  0.080902  0.449132  1
  Ta  Ta109  1  0.501919  0.759198  0.465096  1
  Ta  Ta110  1  0.501919  0.159741  0.548708  1
  Ta  Ta111  1  0.001919  0.926105  0.452390  1
  Ta  Ta112  1  0.001919  0.326452  0.536050  1
  Ta  Ta113  1  0.501919  0.639256  0.455220  1
  Ta  Ta114  1  0.501919  0.039829  0.538814  1
  Ta  Ta115  1  0.001919  0.687360  0.485180  1
  Ta  Ta116  1  0.001919  0.087924  0.568854  1
  Ta  Ta117  1  0.501919  0.718122  0.554768  1
  Ta  Ta118  1  0.501919  0.318729  0.471025  1
  Ta  Ta119  1  0.501919  0.879170  0.476613  1
  Ta  Ta120  1  0.501919  0.279575  0.560291  1
  Ta  Ta121  1  0.501919  0.240680  0.649570  1
  Ta  Ta122  1  0.501919  0.641532  0.732417  1
  Ta  Ta123  1  0.001919  0.606701  0.636076  1
  Ta  Ta124  1  0.001919  0.006488  0.721997  1
  Ta  Ta125  1  0.251564  0.635816  0.589694  1
  Ta  Ta126  1  0.250967  0.035337  0.673909  1
  Ta  Ta127  1  0.001919  0.561733  0.731600  1
  Ta  Ta128  1  0.001919  0.152878  0.652496  1
  Ta  Ta129  1  0.001919  0.243720  0.685845  1
  Ta  Ta130  1  0.001919  0.845190  0.602366  1
  Ta  Ta131  1  0.501919  0.320613  0.611124  1
  Ta  Ta132  1  0.501919  0.720948  0.693603  1
  Ta  Ta133  1  0.252433  0.208711  0.732541  1
  Ta  Ta134  1  0.252708  0.810102  0.653068  1
  Ta  Ta135  1  0.751063  0.590275  0.685107  1
  Ta  Ta136  1  0.751676  0.189802  0.600931  1
  Ta  Ta137  1  0.001919  0.392220  0.619032  1
  Ta  Ta138  1  0.001919  0.795120  0.699563  1
  Ta  Ta139  1  0.001919  0.273187  0.635435  1
  Ta  Ta140  1  0.001919  0.676587  0.719051  1
  Ta  Ta141  1  0.001919  0.461115  0.702398  1
  Ta  Ta142  1  0.001919  0.060141  0.618977  1
  Ta  Ta143  1  0.501919  0.400305  0.713942  1
  Ta  Ta144  1  0.501919  0.999491  0.627525  1
  Ta  Ta145  1  0.001919  0.511119  0.602605  1
  Ta  Ta146  1  0.001919  0.915202  0.686522  1
  Ta  Ta147  1  0.501919  0.310540  0.746894  1
  Ta  Ta148  1  0.501919  0.920106  0.666160  1
  Ta  Ta149  1  0.501919  0.758599  0.604255  1
  Ta  Ta150  1  0.501919  0.159590  0.687198  1
  Ta  Ta151  1  0.001919  0.334210  0.719739  1
  Ta  Ta152  1  0.001919  0.938915  0.635858  1
  Ta  Ta153  1  0.752274  0.635816  0.589694  1
  Ta  Ta154  1  0.752870  0.035337  0.673909  1
  Ta  Ta155  1  0.752740  0.364330  0.665745  1
  Ta  Ta156  1  0.748244  0.767939  0.742870  1
  Ta  Ta157  1  0.001919  0.698995  0.668869  1
  Ta  Ta158  1  0.001919  0.299724  0.585760  1
  Ta  Ta159  1  0.751404  0.208711  0.732541  1
  Ta  Ta160  1  0.751129  0.810102  0.653068  1
  Ta  Ta161  1  0.251097  0.364330  0.665745  1
  Ta  Ta162  1  0.255593  0.767939  0.742870  1
  Ta  Ta163  1  0.501919  0.478216  0.674169  1
  Ta  Ta164  1  0.501919  0.078620  0.588634  1
  Ta  Ta165  1  0.252775  0.590275  0.685107  1
  Ta  Ta166  1  0.252161  0.189802  0.600931  1
  Ta  Ta167  1  0.501919  0.283855  0.698545  1
  Ta  Ta168  1  0.501919  0.881094  0.615901  1
  Ta  Ta169  1  0.501919  0.558996  0.633004  1
  Ta  Ta170  1  0.501919  0.959648  0.715727  1
  Ta  Ta171  1  0.001919  0.726038  0.619264  1
  Ta  Ta172  1  0.001919  0.121537  0.704816  1
  Ta  Ta173  1  0.501919  0.439875  0.623301  1
  Ta  Ta174  1  0.501919  0.841710  0.706416  1
  Ta  Ta175  1  0.001919  0.488079  0.652838  1
  Ta  Ta176  1  0.001919  0.883517  0.734668  1
  Ta  Ta177  1  0.501919  0.520942  0.723193  1
  Ta  Ta178  1  0.501919  0.118041  0.638278  1
  Ta  Ta179  1  0.501919  0.679214  0.643478  1
  Ta  Ta180  1  0.501919  0.079987  0.723764  1
