# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.57779219
_cell_length_b   33.71788060
_cell_length_c   50.69941786
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.06504635
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta330
_cell_volume   12954.0524801
_cell_formula_units_Z   330
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  -0.000264  0.210925  0.328983  1
  Ta  Ta2  1  0.969414  0.906295  0.273466  1
  Ta  Ta3  1  0.003475  0.550764  0.302482  1
  Ta  Ta4  1  0.500780  0.039559  0.342482  1
  Ta  Ta5  1  0.532249  0.729785  0.285473  1
  Ta  Ta6  1  0.483777  0.382649  0.319416  1
  Ta  Ta7  1  0.914343  0.995475  0.286004  1
  Ta  Ta8  1  0.990670  0.638577  0.318400  1
  Ta  Ta9  1  0.059398  0.298848  0.346445  1
  Ta  Ta10  1  0.128069  0.138130  0.305501  1
  Ta  Ta11  1  0.129708  0.784092  0.348187  1
  Ta  Ta12  1  0.052915  0.465852  0.289971  1
  Ta  Ta13  1  0.760313  0.986243  0.333147  1
  Ta  Ta14  1  0.811766  0.678677  0.280650  1
  Ta  Ta15  1  0.748236  0.329488  0.306358  1
  Ta  Ta16  1  0.241010  0.095313  0.349524  1
  Ta  Ta17  1  0.269375  0.783215  0.297921  1
  Ta  Ta18  1  0.215145  0.440844  0.333312  1
  Ta  Ta19  1  0.771597  0.151169  0.314218  1
  Ta  Ta20  1  0.767789  0.809204  0.348204  1
  Ta  Ta21  1  0.720439  0.497725  0.291839  1
  Ta  Ta22  1  0.246134  0.960235  0.282453  1
  Ta  Ta23  1  0.304531  0.601928  0.306842  1
  Ta  Ta24  1  0.325194  0.246129  0.337944  1
  Ta  Ta25  1  0.545126  0.161177  0.272896  1
  Ta  Ta26  1  0.610484  0.811946  0.296955  1
  Ta  Ta27  1  0.560328  0.465203  0.334522  1
  Ta  Ta28  1  0.450110  0.944361  0.328128  1
  Ta  Ta29  1  0.360054  0.613901  0.358151  1
  Ta  Ta30  1  0.380718  0.302592  0.300732  1
  Ta  Ta31  1  0.162567  0.053019  0.296413  1
  Ta  Ta32  1  0.223751  0.704338  0.332161  1
  Ta  Ta33  1  0.162449  0.377358  0.366796  1
  Ta  Ta34  1  0.786761  0.074283  0.296064  1
  Ta  Ta35  1  0.839377  0.710154  0.332802  1
  Ta  Ta36  1  0.742328  0.413722  0.280467  1
  Ta  Ta37  1  0.181637  0.999152  0.335600  1
  Ta  Ta38  1  0.170888  0.692015  0.283025  1
  Ta  Ta39  1  0.111549  0.366749  0.308987  1
  Ta  Ta40  1  0.919769  0.061014  0.343885  1
  Ta  Ta41  1  0.908614  0.759889  0.295421  1
  Ta  Ta42  1  0.849239  0.415113  0.328337  1
  Ta  Ta43  1  0.436391  0.175547  0.324806  1
  Ta  Ta44  1  0.411141  0.844633  0.347918  1
  Ta  Ta45  1  0.374243  0.520837  0.295254  1
  Ta  Ta46  1  0.639846  0.940116  0.280885  1
  Ta  Ta47  1  0.682401  0.593018  0.304748  1
  Ta  Ta48  1  0.699592  0.264255  0.341658  1
  Ta  Ta49  1  0.271975  0.217641  0.284106  1
  Ta  Ta50  1  0.309440  0.880759  0.302409  1
  Ta  Ta51  1  0.266468  0.523521  0.344856  1
  Ta  Ta52  1  0.704910  0.884194  0.317006  1
  Ta  Ta53  1  0.626717  0.548947  0.346520  1
  Ta  Ta54  1  0.639057  0.236387  0.293158  1
  Ta  Ta55  1  0.454186  0.098504  0.302511  1
  Ta  Ta56  1  0.515457  0.754987  0.337051  1
  Ta  Ta57  1  0.399414  0.440102  0.284273  1
  Ta  Ta58  1  0.511993  1.015355  0.290884  1
  Ta  Ta59  1  0.537776  0.664855  0.317606  1
  Ta  Ta60  1  0.432058  0.322336  0.354598  1
  Ta  Ta61  1  0.014081  0.928491  0.323421  1
  Ta  Ta62  1  -0.001577  0.579104  0.354505  1
  Ta  Ta63  1  0.011916  0.274832  0.294552  1
  Ta  Ta64  1  0.923727  0.194983  0.274446  1
  Ta  Ta65  1  0.004801  0.838687  0.307148  1
  Ta  Ta66  1  0.917162  0.494919  0.341114  1
  Ta  Ta67  1  0.983244  0.175208  0.420905  1
  Ta  Ta68  1  0.016614  0.866862  0.359473  1
  Ta  Ta69  1  0.962664  0.520221  0.392600  1
  Ta  Ta70  1  0.497744  1.004997  0.434160  1
  Ta  Ta71  1  0.493422  0.692641  0.372678  1
  Ta  Ta72  1  0.474569  0.345777  0.408975  1
  Ta  Ta73  1  0.938249  0.966722  0.378370  1
  Ta  Ta74  1  0.040161  0.605212  0.408129  1
  Ta  Ta75  1  0.913010  0.272315  0.441831  1
  Ta  Ta76  1  0.080421  0.099133  0.402966  1
  Ta  Ta77  1  0.207347  0.774760  0.439269  1
  Ta  Ta78  1  0.887875  0.434813  0.379872  1
  Ta  Ta79  1  0.752948  0.950493  0.423927  1
  Ta  Ta80  1  0.733312  0.634981  0.363028  1
  Ta  Ta81  1  0.736317  0.289248  0.395753  1
  Ta  Ta82  1  0.238956  0.059451  0.444274  1
  Ta  Ta83  1  0.214433  0.738105  0.389297  1
  Ta  Ta84  1  0.209492  0.402608  0.421188  1
  Ta  Ta85  1  0.726695  0.125141  0.407522  1
  Ta  Ta86  1  0.796374  0.758942  0.435754  1
  Ta  Ta87  1  0.603879  0.491341  0.387700  1
  Ta  Ta88  1  0.257618  0.923430  0.370910  1
  Ta  Ta89  1  0.325844  0.550447  0.395800  1
  Ta  Ta90  1  0.224795  0.229282  0.433435  1
  Ta  Ta91  1  0.601561  0.115170  0.355763  1
  Ta  Ta92  1  0.525577  0.780258  0.390110  1
  Ta  Ta93  1  0.580717  0.426691  0.426170  1
  Ta  Ta94  1  0.444035  0.908339  0.417522  1
  Ta  Ta95  1  0.375054  0.575407  0.447217  1
  Ta  Ta96  1  0.404301  0.252749  0.389703  1
  Ta  Ta97  1  0.184372  0.022463  0.388049  1
  Ta  Ta98  1  0.389760  0.639350  0.411760  1
  Ta  Ta99  1  0.155103  0.328644  0.453774  1
  Ta  Ta100  1  0.765026  0.042691  0.391637  1
  Ta  Ta101  1  0.089886  0.693689  0.430637  1
  Ta  Ta102  1  0.794241  0.350104  0.359931  1
  Ta  Ta103  1  0.181969  0.963128  0.426631  1
  Ta  Ta104  1  0.074382  0.665525  0.373975  1
  Ta  Ta105  1  0.136665  0.309687  0.400353  1
  Ta  Ta106  1  0.923339  0.021553  0.437360  1
  Ta  Ta107  1  0.823760  0.727723  0.384181  1
  Ta  Ta108  1  0.870433  0.367698  0.412511  1
  Ta  Ta109  1  0.406606  0.156826  0.420009  1
  Ta  Ta110  1  0.509884  0.815181  0.446303  1
  Ta  Ta111  1  0.249736  0.464210  0.384981  1
  Ta  Ta112  1  0.684082  0.908890  0.367764  1
  Ta  Ta113  1  0.679301  0.578029  0.401402  1
  Ta  Ta114  1  0.663100  0.216594  0.427938  1
  Ta  Ta115  1  0.269299  0.173124  0.373049  1
  Ta  Ta116  1  0.275987  0.838081  0.401325  1
  Ta  Ta117  1  0.301456  0.492844  0.436557  1
  Ta  Ta118  1  0.686924  0.850587  0.403821  1
  Ta  Ta119  1  0.662070  0.516400  0.439371  1
  Ta  Ta120  1  0.660902  0.196345  0.372310  1
  Ta  Ta121  1  0.433705  0.078118  0.397175  1
  Ta  Ta122  1  0.485931  0.718509  0.428134  1
  Ta  Ta123  1  0.526466  0.406407  0.373286  1
  Ta  Ta124  1  0.508753  0.981493  0.381591  1
  Ta  Ta125  1  0.760319  0.661555  0.419421  1
  Ta  Ta126  1  0.470941  0.284623  0.445233  1
  Ta  Ta127  1  0.004622  0.893402  0.412782  1
  Ta  Ta128  1  0.008413  0.545310  0.443891  1
  Ta  Ta129  1  0.001655  0.234102  0.383201  1
  Ta  Ta130  1  0.942581  0.143420  0.362386  1
  Ta  Ta131  1  0.960604  0.801068  0.396430  1
  Ta  Ta132  1  0.937234  0.459440  0.430863  1
  Ta  Ta133  1  0.984481  0.137939  0.512574  1
  Ta  Ta134  1  0.955368  0.832430  0.449780  1
  Ta  Ta135  1  0.931868  0.489045  0.482255  1
  Ta  Ta136  1  0.491511  0.966095  0.526049  1
  Ta  Ta137  1  0.465351  0.656428  0.465062  1
  Ta  Ta138  1  0.475608  0.309871  0.498952  1
  Ta  Ta139  1  0.944269  0.931263  0.469340  1
  Ta  Ta140  1  0.840703  0.561244  0.504714  1
  Ta  Ta141  1  0.921549  0.235220  0.532446  1
  Ta  Ta142  1  0.082457  0.061784  0.496433  1
  Ta  Ta143  1  0.093983  0.717143  0.527453  1
  Ta  Ta144  1  0.964170  0.397973  0.467723  1
  Ta  Ta145  1  0.746483  0.912866  0.514301  1
  Ta  Ta146  1  0.724307  0.598171  0.457094  1
  Ta  Ta147  1  0.726095  0.253295  0.487347  1
  Ta  Ta148  1  0.239505  0.020891  0.538840  1
  Ta  Ta149  1  0.222686  0.711554  0.478757  1
  Ta  Ta150  1  0.223255  0.366012  0.511956  1
  Ta  Ta151  1  0.734304  0.083707  0.501589  1
  Ta  Ta152  1  0.744938  0.734402  0.528715  1
  Ta  Ta153  1  0.645296  0.440845  0.477439  1
  Ta  Ta154  1  0.245625  0.880962  0.459758  1
  Ta  Ta155  1  0.188589  0.547911  0.491664  1
  Ta  Ta156  1  0.232175  0.192367  0.523385  1
  Ta  Ta157  1  0.584215  0.081060  0.449536  1
  Ta  Ta158  1  0.549037  0.744550  0.479498  1
  Ta  Ta159  1  0.662034  0.379550  0.514022  1
  Ta  Ta160  1  0.437033  0.869853  0.506446  1
  Ta  Ta161  1  0.464644  0.535688  0.540573  1
  Ta  Ta162  1  0.417944  0.210562  0.478146  1
  Ta  Ta163  1  0.179264  0.986634  0.480038  1
  Ta  Ta164  1  0.151232  0.639711  0.512539  1
  Ta  Ta165  1  0.168243  0.292402  0.544002  1
  Ta  Ta166  1  0.753910  1.003913  0.482750  1
  Ta  Ta167  1  0.782255  0.639059  0.516046  1
  Ta  Ta168  1  0.716312  0.341195  0.456803  1
  Ta  Ta169  1  0.177273  0.925307  0.517504  1
  Ta  Ta170  1  0.079911  0.624228  0.462452  1
  Ta  Ta171  1  0.165922  0.266680  0.490631  1
  Ta  Ta172  1  0.920724  0.984714  0.528223  1
  Ta  Ta173  1  0.824392  0.687285  0.474228  1
  Ta  Ta174  1  0.916703  0.323654  0.501286  1
  Ta  Ta175  1  0.413379  0.118974  0.509648  1
  Ta  Ta176  1  0.415987  0.768707  0.535592  1
  Ta  Ta177  1  0.246044  0.450072  0.478854  1
  Ta  Ta178  1  0.679486  0.881619  0.459263  1
  Ta  Ta179  1  0.517636  0.515578  0.488635  1
  Ta  Ta180  1  0.665756  0.179114  0.520377  1
  Ta  Ta181  1  0.243095  0.137909  0.465008  1
  Ta  Ta182  1  0.264459  0.800708  0.492248  1
  Ta  Ta183  1  0.414622  0.438636  0.525419  1
  Ta  Ta184  1  0.688674  0.814870  0.495329  1
  Ta  Ta185  1  0.730704  0.480332  0.529917  1
  Ta  Ta186  1  0.670995  0.156738  0.466779  1
  Ta  Ta187  1  0.432208  0.039857  0.491252  1
  Ta  Ta188  1  0.466958  0.683486  0.518245  1
  Ta  Ta189  1  0.410942  0.380423  0.466704  1
  Ta  Ta190  1  0.487037  0.945533  0.472555  1
  Ta  Ta191  1  0.466480  0.597682  0.502241  1
  Ta  Ta192  1  0.480059  0.248409  0.535599  1
  Ta  Ta193  1  0.000086  0.856322  0.503449  1
  Ta  Ta194  1  0.136462  0.496556  0.533336  1
  Ta  Ta195  1  0.984445  0.197840  0.474614  1
  Ta  Ta196  1  0.927129  0.102272  0.454106  1
  Ta  Ta197  1  0.950185  0.763263  0.484211  1
  Ta  Ta198  1  0.976650  0.422760  0.521154  1
  Ta  Ta199  1  0.985202  0.097453  0.602841  1
  Ta  Ta200  1  0.988301  0.793935  0.540373  1
  Ta  Ta201  1  0.915137  0.462128  0.576150  1
  Ta  Ta202  1  0.487644  0.924656  0.617343  1
  Ta  Ta203  1  0.501758  0.616456  0.556409  1
  Ta  Ta204  1  0.479651  0.273579  0.588760  1
  Ta  Ta205  1  0.926604  0.890501  0.559207  1
  Ta  Ta206  1  0.832785  0.529701  0.612428  1
  Ta  Ta207  1  0.926133  0.195963  0.621242  1
  Ta  Ta208  1  0.084269  0.020282  0.589261  1
  Ta  Ta209  1  0.096017  0.676483  0.619098  1
  Ta  Ta210  1  0.979469  0.362016  0.558766  1
  Ta  Ta211  1  0.738124  0.871539  0.604385  1
  Ta  Ta212  1  0.813154  0.554895  0.560623  1
  Ta  Ta213  1  0.727900  0.216258  0.577285  1
  Ta  Ta214  1  0.237591  0.977067  0.633731  1
  Ta  Ta215  1  0.251914  0.675546  0.567874  1
  Ta  Ta216  1  0.226413  0.329588  0.600761  1
  Ta  Ta217  1  0.735783  0.041042  0.595268  1
  Ta  Ta218  1  0.750325  0.693332  0.623532  1
  Ta  Ta219  1  0.666513  0.405548  0.566853  1
  Ta  Ta220  1  0.244655  0.848001  0.551078  1
  Ta  Ta221  1  0.175010  0.516797  0.586786  1
  Ta  Ta222  1  0.234353  0.152275  0.612775  1
  Ta  Ta223  1  0.583729  0.041100  0.542950  1
  Ta  Ta224  1  0.597427  0.693740  0.571262  1
  Ta  Ta225  1  0.666384  0.342822  0.603367  1
  Ta  Ta226  1  0.428195  0.828932  0.597025  1
  Ta  Ta227  1  0.466461  0.495436  0.633918  1
  Ta  Ta228  1  0.421308  0.172978  0.568170  1
  Ta  Ta229  1  0.177350  0.944877  0.571230  1
  Ta  Ta230  1  0.121394  0.597677  0.601075  1
  Ta  Ta231  1  0.168498  0.252905  0.633632  1
  Ta  Ta232  1  0.749376  0.964112  0.572719  1
  Ta  Ta233  1  0.753943  0.614087  0.606552  1
  Ta  Ta234  1  0.726944  0.305458  0.546590  1
  Ta  Ta235  1  0.173351  0.884063  0.608884  1
  Ta  Ta236  1  0.153885  0.581370  0.547598  1
  Ta  Ta237  1  0.170055  0.229541  0.580042  1
  Ta  Ta238  1  0.925016  0.945247  0.616438  1
  Ta  Ta239  1  0.909628  0.647215  0.564224  1
  Ta  Ta240  1  0.919743  0.286150  0.591618  1
  Ta  Ta241  1  0.416065  0.079341  0.597622  1
  Ta  Ta242  1  0.439149  0.730206  0.618493  1
  Ta  Ta243  1  0.229158  0.420698  0.570096  1
  Ta  Ta244  1  0.667183  0.833322  0.548109  1
  Ta  Ta245  1  0.510153  0.479217  0.579912  1
  Ta  Ta246  1  0.668352  0.138535  0.610841  1
  Ta  Ta247  1  0.241086  0.101782  0.554239  1
  Ta  Ta248  1  0.248691  0.761159  0.581468  1
  Ta  Ta249  1  0.414093  0.401037  0.614845  1
  Ta  Ta250  1  0.673069  0.773714  0.585335  1
  Ta  Ta251  1  0.729948  0.441597  0.622400  1
  Ta  Ta252  1  0.671310  0.117971  0.557745  1
  Ta  Ta253  1  0.430515  0.997037  0.586084  1
  Ta  Ta254  1  0.424890  0.644300  0.614239  1
  Ta  Ta255  1  0.419858  0.348841  0.556348  1
  Ta  Ta256  1  0.496041  0.904374  0.563206  1
  Ta  Ta257  1  0.469972  0.561048  0.596346  1
  Ta  Ta258  1  0.481871  0.209210  0.623363  1
  Ta  Ta259  1  0.988141  0.815981  0.594333  1
  Ta  Ta260  1  0.136668  0.459608  0.626182  1
  Ta  Ta261  1  0.985219  0.160006  0.565941  1
  Ta  Ta262  1  0.927812  0.063168  0.548467  1
  Ta  Ta263  1  0.941391  0.724353  0.578321  1
  Ta  Ta264  1  0.979766  0.385891  0.611994  1
  Ta  Ta265  1  -0.003523  0.059752  0.693255  1
  Ta  Ta266  1  0.987683  0.754000  0.631117  1
  Ta  Ta267  1  0.913906  0.419746  0.668556  1
  Ta  Ta268  1  0.480798  0.878516  0.707790  1
  Ta  Ta269  1  0.555693  0.572769  0.650782  1
  Ta  Ta270  1  0.484522  0.232180  0.675811  1
  Ta  Ta271  1  0.921313  0.849595  0.649339  1
  Ta  Ta272  1  0.811948  0.475388  0.711067  1
  Ta  Ta273  1  0.932540  0.154512  0.707858  1
  Ta  Ta274  1  0.076307  0.978421  0.682833  1
  Ta  Ta275  1  0.063456  0.628043  0.711329  1
  Ta  Ta276  1  0.979042  0.321283  0.648016  1
  Ta  Ta277  1  0.737101  0.825548  0.692789  1
  Ta  Ta278  1  0.830891  0.507254  0.663007  1
  Ta  Ta279  1  0.732374  0.173369  0.663838  1
  Ta  Ta280  1  0.184294  0.921021  0.717781  1
  Ta  Ta281  1  0.235533  0.628715  0.661275  1
  Ta  Ta282  1  0.226306  0.284332  0.689007  1
  Ta  Ta283  1  0.728748  1.002252  0.690255  1
  Ta  Ta284  1  0.716951  0.653149  0.711810  1
  Ta  Ta285  1  0.666273  0.364581  0.656753  1
  Ta  Ta286  1  0.247309  0.807474  0.642737  1
  Ta  Ta287  1  0.180697  0.474289  0.679862  1
  Ta  Ta288  1  0.257577  0.115754  0.702620  1
  Ta  Ta289  1  0.582281  0.998869  0.636829  1
  Ta  Ta290  1  0.585084  0.653195  0.663486  1
  Ta  Ta291  1  0.655594  0.302500  0.691695  1
  Ta  Ta292  1  0.404595  0.786393  0.691470  1
  Ta  Ta293  1  0.453135  0.447131  0.723501  1
  Ta  Ta294  1  0.423629  0.131375  0.657224  1
  Ta  Ta295  1  0.172506  0.904797  0.662356  1
  Ta  Ta296  1  0.100210  0.549239  0.698057  1
  Ta  Ta297  1  0.211054  0.208875  0.717477  1
  Ta  Ta298  1  0.750782  0.925462  0.658855  1
  Ta  Ta299  1  0.754399  0.572199  0.701693  1
  Ta  Ta300  1  0.730388  0.265129  0.637059  1
  Ta  Ta301  1  0.141775  0.844532  0.697455  1
  Ta  Ta302  1  0.193300  0.547655  0.645629  1
  Ta  Ta303  1  0.172401  0.188396  0.667797  1
  Ta  Ta304  1  0.840070  0.904332  0.704996  1
  Ta  Ta305  1  0.896922  0.605350  0.656344  1
  Ta  Ta306  1  0.905040  0.241226  0.684102  1
  Ta  Ta307  1  0.391844  0.036948  0.686302  1
  Ta  Ta308  1  0.362815  0.682377  0.706532  1
  Ta  Ta309  1  0.227520  0.379568  0.659382  1
  Ta  Ta310  1  0.657111  0.790413  0.640381  1
  Ta  Ta311  1  0.507119  0.435868  0.671820  1
  Ta  Ta312  1  0.662743  0.096507  0.699670  1
  Ta  Ta313  1  0.245174  0.060539  0.642187  1
  Ta  Ta314  1  0.288515  0.720324  0.662787  1
  Ta  Ta315  1  0.397528  0.358721  0.703830  1
  Ta  Ta316  1  0.662507  0.731613  0.677570  1
  Ta  Ta317  1  0.722451  0.393878  0.712865  1
  Ta  Ta318  1  0.673299  0.076118  0.648160  1
  Ta  Ta319  1  0.446847  0.950670  0.682193  1
  Ta  Ta320  1  0.408957  0.597509  0.703023  1
  Ta  Ta321  1  0.419071  0.309003  0.645360  1
  Ta  Ta322  1  0.499761  0.863510  0.655691  1
  Ta  Ta323  1  0.484452  0.516298  0.691528  1
  Ta  Ta324  1  0.532054  0.171571  0.709480  1
  Ta  Ta325  1  0.005175  0.771105  0.683382  1
  Ta  Ta326  1  0.128102  0.413434  0.713698  1
  Ta  Ta327  1  0.991931  0.118021  0.656110  1
  Ta  Ta328  1  0.929463  0.020908  0.642609  1
  Ta  Ta329  1  0.966723  0.685814  0.675084  1
  Ta  Ta330  1  0.980389  0.340446  0.700184  1
