# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.29261046
_cell_length_b   22.65347088
_cell_length_c   54.41703960
_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   6524.3852073
_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  0.502125  0.639541  0.317131  1
  Ta  Ta2  1  0.502125  0.039136  0.399651  1
  Ta  Ta3  1  0.002125  0.006348  0.303735  1
  Ta  Ta4  1  0.002125  0.407701  0.385130  1
  Ta  Ta5  1  0.258177  0.035622  0.260994  1
  Ta  Ta6  1  0.250750  0.434866  0.337825  1
  Ta  Ta7  1  0.002125  0.954189  0.401690  1
  Ta  Ta8  1  0.002125  0.554576  0.319049  1
  Ta  Ta9  1  0.002125  0.644696  0.351640  1
  Ta  Ta10  1  0.002125  0.235701  0.270286  1
  Ta  Ta11  1  0.502125  0.716339  0.278480  1
  Ta  Ta12  1  0.502125  0.120126  0.360814  1
  Ta  Ta13  1  0.253395  0.608789  0.403072  1
  Ta  Ta14  1  0.254029  0.209280  0.319102  1
  Ta  Ta15  1  0.750712  0.988893  0.350342  1
  Ta  Ta16  1  0.752607  0.590714  0.271162  1
  Ta  Ta17  1  0.002125  0.790310  0.281264  1
  Ta  Ta18  1  0.002125  0.190749  0.367335  1
  Ta  Ta19  1  0.002125  0.676255  0.300018  1
  Ta  Ta20  1  0.002125  0.073285  0.383850  1
  Ta  Ta21  1  0.002125  0.861126  0.367618  1
  Ta  Ta22  1  0.002125  0.466379  0.284669  1
  Ta  Ta23  1  0.502125  0.799252  0.376296  1
  Ta  Ta24  1  0.502125  0.399440  0.290211  1
  Ta  Ta25  1  0.002125  0.916281  0.269050  1
  Ta  Ta26  1  0.002125  0.311120  0.351419  1
  Ta  Ta27  1  0.502125  0.720930  0.414665  1
  Ta  Ta28  1  0.502125  0.321375  0.329209  1
  Ta  Ta29  1  0.502125  0.159824  0.270899  1
  Ta  Ta30  1  0.502125  0.558692  0.353734  1
  Ta  Ta31  1  0.002125  0.737500  0.385115  1
  Ta  Ta32  1  0.002125  0.336375  0.302010  1
  Ta  Ta33  1  0.746074  0.035622  0.260994  1
  Ta  Ta34  1  0.753501  0.434866  0.337825  1
  Ta  Ta35  1  0.753657  0.763188  0.329979  1
  Ta  Ta36  1  0.753376  0.162933  0.414093  1
  Ta  Ta37  1  0.002125  0.099583  0.334686  1
  Ta  Ta38  1  0.002125  0.692176  0.249945  1
  Ta  Ta39  1  0.750856  0.608789  0.403072  1
  Ta  Ta40  1  0.750222  0.209280  0.319102  1
  Ta  Ta41  1  0.250594  0.763188  0.329979  1
  Ta  Ta42  1  0.250875  0.162933  0.414093  1
  Ta  Ta43  1  0.502125  0.877595  0.338171  1
  Ta  Ta44  1  0.502125  0.485817  0.254544  1
  Ta  Ta45  1  0.253538  0.988893  0.350342  1
  Ta  Ta46  1  0.251643  0.590714  0.271162  1
  Ta  Ta47  1  0.502125  0.682130  0.365834  1
  Ta  Ta48  1  0.502125  0.280744  0.280508  1
  Ta  Ta49  1  0.502125  0.956567  0.298164  1
  Ta  Ta50  1  0.502125  0.358030  0.380726  1
  Ta  Ta51  1  0.002125  0.124260  0.285741  1
  Ta  Ta52  1  0.002125  0.524585  0.369232  1
  Ta  Ta53  1  0.502125  0.840475  0.288785  1
  Ta  Ta54  1  0.502125  0.240908  0.371010  1
  Ta  Ta55  1  0.002125  0.885561  0.316742  1
  Ta  Ta56  1  0.002125  0.287498  0.400688  1
  Ta  Ta57  1  0.502125  0.916445  0.387424  1
  Ta  Ta58  1  0.502125  0.514609  0.304064  1
  Ta  Ta59  1  0.502125  0.078590  0.309750  1
  Ta  Ta60  1  0.502125  0.478035  0.392231  1
  Ta  Ta61  1  0.502125  0.439104  0.483086  1
  Ta  Ta62  1  0.502125  0.839161  0.566595  1
  Ta  Ta63  1  0.002125  0.807798  0.469083  1
  Ta  Ta64  1  0.002125  0.208181  0.552592  1
  Ta  Ta65  1  0.250805  0.835711  0.422313  1
  Ta  Ta66  1  0.250821  0.236039  0.505804  1
  Ta  Ta67  1  0.002125  0.754265  0.568696  1
  Ta  Ta68  1  0.002125  0.354420  0.485095  1
  Ta  Ta69  1  0.002125  0.444066  0.518547  1
  Ta  Ta70  1  0.002125  0.044176  0.434944  1
  Ta  Ta71  1  0.502125  0.519632  0.444118  1
  Ta  Ta72  1  0.502125  0.919907  0.527696  1
  Ta  Ta73  1  0.253433  0.409094  0.570343  1
  Ta  Ta74  1  0.253409  0.009059  0.486528  1
  Ta  Ta75  1  0.750842  0.789380  0.517099  1
  Ta  Ta76  1  0.750813  0.389390  0.433300  1
  Ta  Ta77  1  0.002125  0.590286  0.451036  1
  Ta  Ta78  1  0.002125  0.990643  0.534537  1
  Ta  Ta79  1  0.002125  0.472924  0.467280  1
  Ta  Ta80  1  0.002125  0.873183  0.550855  1
  Ta  Ta81  1  0.002125  0.661009  0.535010  1
  Ta  Ta82  1  0.002125  0.261497  0.451183  1
  Ta  Ta83  1  0.502125  0.598949  0.543742  1
  Ta  Ta84  1  0.502125  0.199518  0.459903  1
  Ta  Ta85  1  0.002125  0.711018  0.435496  1
  Ta  Ta86  1  0.002125  0.111345  0.518979  1
  Ta  Ta87  1  0.502125  0.520650  0.582101  1
  Ta  Ta88  1  0.502125  0.121090  0.498123  1
  Ta  Ta89  1  0.502125  0.959275  0.437033  1
  Ta  Ta90  1  0.502125  0.359381  0.520556  1
  Ta  Ta91  1  0.002125  0.536977  0.552467  1
  Ta  Ta92  1  0.002125  0.137449  0.468627  1
  Ta  Ta93  1  0.753446  0.835711  0.422313  1
  Ta  Ta94  1  0.753429  0.236039  0.505804  1
  Ta  Ta95  1  0.753429  0.562435  0.497833  1
  Ta  Ta96  1  0.753452  0.962732  0.581299  1
  Ta  Ta97  1  0.002125  0.899217  0.501812  1
  Ta  Ta98  1  0.002125  0.498896  0.418189  1
  Ta  Ta99  1  0.750818  0.409094  0.570343  1
  Ta  Ta100  1  0.750842  0.009059  0.486528  1
  Ta  Ta101  1  0.250822  0.562435  0.497833  1
  Ta  Ta102  1  0.250799  0.962732  0.581299  1
  Ta  Ta103  1  0.502125  0.677364  0.505508  1
  Ta  Ta104  1  0.502125  0.277826  0.421553  1
  Ta  Ta105  1  0.253408  0.789380  0.517099  1
  Ta  Ta106  1  0.253438  0.389390  0.433300  1
  Ta  Ta107  1  0.502125  0.481520  0.532913  1
  Ta  Ta108  1  0.502125  0.081887  0.449153  1
  Ta  Ta109  1  0.502125  0.757928  0.465045  1
  Ta  Ta110  1  0.502125  0.158257  0.548508  1
  Ta  Ta111  1  0.002125  0.925249  0.452769  1
  Ta  Ta112  1  0.002125  0.325557  0.536358  1
  Ta  Ta113  1  0.502125  0.640208  0.455114  1
  Ta  Ta114  1  0.502125  0.040519  0.538571  1
  Ta  Ta115  1  0.002125  0.687112  0.484645  1
  Ta  Ta116  1  0.002125  0.087437  0.568118  1
  Ta  Ta117  1  0.502125  0.716565  0.554485  1
  Ta  Ta118  1  0.502125  0.316961  0.470733  1
  Ta  Ta119  1  0.502125  0.878528  0.475927  1
  Ta  Ta120  1  0.502125  0.278836  0.559512  1
  Ta  Ta121  1  0.502125  0.239791  0.649821  1
  Ta  Ta122  1  0.502125  0.638680  0.732736  1
  Ta  Ta123  1  0.002125  0.607731  0.636330  1
  Ta  Ta124  1  0.002125  0.008853  0.722407  1
  Ta  Ta125  1  0.250875  0.635531  0.589561  1
  Ta  Ta126  1  0.250039  0.035397  0.673547  1
  Ta  Ta127  1  0.002125  0.562780  0.733340  1
  Ta  Ta128  1  0.002125  0.153605  0.652124  1
  Ta  Ta129  1  0.002125  0.243560  0.684554  1
  Ta  Ta130  1  0.002125  0.844259  0.601939  1
  Ta  Ta131  1  0.502125  0.320455  0.611384  1
  Ta  Ta132  1  0.502125  0.719954  0.693899  1
  Ta  Ta133  1  0.252427  0.207413  0.731934  1
  Ta  Ta134  1  0.253529  0.809629  0.653301  1
  Ta  Ta135  1  0.750217  0.589174  0.684558  1
  Ta  Ta136  1  0.750906  0.189657  0.600549  1
  Ta  Ta137  1  0.002125  0.390761  0.618512  1
  Ta  Ta138  1  0.002125  0.792285  0.699903  1
  Ta  Ta139  1  0.002125  0.273822  0.634398  1
  Ta  Ta140  1  0.002125  0.674297  0.717915  1
  Ta  Ta141  1  0.002125  0.461940  0.701662  1
  Ta  Ta142  1  0.002125  0.061018  0.618489  1
  Ta  Ta143  1  0.502125  0.398737  0.713484  1
  Ta  Ta144  1  0.502125  0.999199  0.627284  1
  Ta  Ta145  1  0.002125  0.510976  0.602972  1
  Ta  Ta146  1  0.002125  0.913162  0.686906  1
  Ta  Ta147  1  0.502125  0.311717  0.748972  1
  Ta  Ta148  1  0.502125  0.920950  0.665447  1
  Ta  Ta149  1  0.502125  0.759319  0.603993  1
  Ta  Ta150  1  0.502125  0.159240  0.686248  1
  Ta  Ta151  1  0.002125  0.331630  0.718923  1
  Ta  Ta152  1  0.002125  0.937332  0.635987  1
  Ta  Ta153  1  0.753375  0.635531  0.589561  1
  Ta  Ta154  1  0.754212  0.035397  0.673547  1
  Ta  Ta155  1  0.753544  0.363558  0.665804  1
  Ta  Ta156  1  0.746092  0.763018  0.742629  1
  Ta  Ta157  1  0.002125  0.698933  0.668978  1
  Ta  Ta158  1  0.002125  0.299570  0.585445  1
  Ta  Ta159  1  0.751824  0.207413  0.731934  1
  Ta  Ta160  1  0.750722  0.809629  0.653301  1
  Ta  Ta161  1  0.250706  0.363558  0.665804  1
  Ta  Ta162  1  0.258159  0.763018  0.742629  1
  Ta  Ta163  1  0.502125  0.477003  0.674477  1
  Ta  Ta164  1  0.502125  0.077530  0.588931  1
  Ta  Ta165  1  0.254034  0.589174  0.684558  1
  Ta  Ta166  1  0.253345  0.189657  0.600549  1
  Ta  Ta167  1  0.502125  0.283719  0.699425  1
  Ta  Ta168  1  0.502125  0.882001  0.616200  1
  Ta  Ta169  1  0.502125  0.557550  0.632659  1
  Ta  Ta170  1  0.502125  0.958018  0.714784  1
  Ta  Ta171  1  0.002125  0.725187  0.619806  1
  Ta  Ta172  1  0.002125  0.121856  0.704365  1
  Ta  Ta173  1  0.502125  0.440444  0.622929  1
  Ta  Ta174  1  0.502125  0.842035  0.705466  1
  Ta  Ta175  1  0.002125  0.487332  0.652248  1
  Ta  Ta176  1  0.002125  0.882555  0.734559  1
  Ta  Ta177  1  0.502125  0.517613  0.723148  1
  Ta  Ta178  1  0.502125  0.116337  0.637746  1
  Ta  Ta179  1  0.502125  0.678354  0.642845  1
  Ta  Ta180  1  0.502125  0.081110  0.723041  1
