# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.60788172
_cell_length_b   16.23670335
_cell_length_c   50.21026810
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.93555097
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta220
_cell_volume   8648.0619186
_cell_formula_units_Z   220
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  1.004703  0.271268  0.276857  1
  Ta  Ta2  1  1.020081  0.817575  0.317713  1
  Ta  Ta3  1  0.516877  0.543804  0.293566  1
  Ta  Ta4  1  0.519267  0.085949  0.338266  1
  Ta  Ta5  1  0.345128  0.385782  0.357492  1
  Ta  Ta6  1  0.335730  0.848066  0.311501  1
  Ta  Ta7  1  0.773785  0.775755  0.318535  1
  Ta  Ta8  1  0.763183  0.225346  0.274648  1
  Ta  Ta9  1  0.333329  0.431470  0.305456  1
  Ta  Ta10  1  0.341132  0.971697  0.349089  1
  Ta  Ta11  1  0.674883  0.670032  0.280604  1
  Ta  Ta12  1  0.691608  0.203127  0.324781  1
  Ta  Ta13  1  0.846220  0.475648  0.349468  1
  Ta  Ta14  1  0.856178  0.938481  0.300478  1
  Ta  Ta15  1  0.202715  0.704445  0.328567  1
  Ta  Ta16  1  0.197943  0.162013  0.285693  1
  Ta  Ta17  1  0.774927  0.509600  0.295348  1
  Ta  Ta18  1  0.770138  0.045401  0.341546  1
  Ta  Ta19  1  0.201085  0.581667  0.292184  1
  Ta  Ta20  1  0.198024  0.115037  0.336543  1
  Ta  Ta21  1  0.520380  0.733177  0.325175  1
  Ta  Ta22  1  0.504168  0.188801  0.281064  1
  Ta  Ta23  1  0.583816  0.466249  0.347534  1
  Ta  Ta24  1  0.590202  0.920454  0.308974  1
  Ta  Ta25  1  0.393264  0.690282  0.281381  1
  Ta  Ta26  1  0.381505  0.232113  0.324943  1
  Ta  Ta27  1  0.575292  0.350294  0.309453  1
  Ta  Ta28  1  0.574214  0.887527  0.359900  1
  Ta  Ta29  1  0.966315  0.621805  0.338141  1
  Ta  Ta30  1  0.947096  0.096680  0.292395  1
  Ta  Ta31  1  0.159347  0.502812  0.346577  1
  Ta  Ta32  1  0.145350  0.963090  0.300548  1
  Ta  Ta33  1  0.945922  0.657702  0.287825  1
  Ta  Ta34  1  0.957056  0.204547  0.331191  1
  Ta  Ta35  1  0.026915  0.460201  0.301573  1
  Ta  Ta36  1  1.019684  0.001971  0.346899  1
  Ta  Ta37  1  0.700568  0.616245  0.333548  1
  Ta  Ta38  1  0.677339  0.066026  0.287590  1
  Ta  Ta39  1  0.386911  0.585159  0.338250  1
  Ta  Ta40  1  0.382800  0.040319  0.295100  1
  Ta  Ta41  1  0.162691  0.763785  0.277224  1
  Ta  Ta42  1  0.154556  0.313120  0.317965  1
  Ta  Ta43  1  0.838491  0.348464  0.311772  1
  Ta  Ta44  1  0.836352  0.888831  0.357585  1
  Ta  Ta45  1  1.022241  0.359698  0.361961  1
  Ta  Ta46  1  1.023623  0.898409  0.406534  1
  Ta  Ta47  1  0.525269  0.628403  0.382894  1
  Ta  Ta48  1  0.523688  0.170476  0.428852  1
  Ta  Ta49  1  0.351658  0.468372  0.446669  1
  Ta  Ta50  1  0.344070  0.927427  0.402963  1
  Ta  Ta51  1  0.775227  0.856788  0.413014  1
  Ta  Ta52  1  0.771198  0.316862  0.365355  1
  Ta  Ta53  1  0.348063  0.513203  0.393760  1
  Ta  Ta54  1  0.342138  0.055892  0.438556  1
  Ta  Ta55  1  0.705421  0.743710  0.372550  1
  Ta  Ta56  1  0.707063  0.285380  0.420474  1
  Ta  Ta57  1  0.850133  0.559386  0.445269  1
  Ta  Ta58  1  0.842440  0.014683  0.397461  1
  Ta  Ta59  1  0.205576  0.784558  0.416946  1
  Ta  Ta60  1  0.202551  0.243994  0.372828  1
  Ta  Ta61  1  0.774444  0.586309  0.388971  1
  Ta  Ta62  1  0.771021  0.125079  0.436838  1
  Ta  Ta63  1  0.204577  0.656053  0.381270  1
  Ta  Ta64  1  0.203735  0.198831  0.425866  1
  Ta  Ta65  1  0.525071  0.812625  0.414817  1
  Ta  Ta66  1  0.523221  0.271103  0.369017  1
  Ta  Ta67  1  0.589435  0.548200  0.438275  1
  Ta  Ta68  1  0.580789  0.011248  0.394502  1
  Ta  Ta69  1  0.384565  0.772865  0.369736  1
  Ta  Ta70  1  0.391841  0.315092  0.414429  1
  Ta  Ta71  1  0.585427  0.429249  0.400752  1
  Ta  Ta72  1  0.582084  0.974550  0.447141  1
  Ta  Ta73  1  0.969828  0.698176  0.425145  1
  Ta  Ta74  1  0.965820  0.159198  0.382489  1
  Ta  Ta75  1  0.163395  0.585126  0.437604  1
  Ta  Ta76  1  0.158362  0.043426  0.392167  1
  Ta  Ta77  1  0.966727  0.744372  0.373669  1
  Ta  Ta78  1  0.968103  0.281576  0.417592  1
  Ta  Ta79  1  0.025762  0.542909  0.392763  1
  Ta  Ta80  1  1.022476  0.083697  0.437864  1
  Ta  Ta81  1  0.706419  0.700312  0.429524  1
  Ta  Ta82  1  0.705367  0.158105  0.381509  1
  Ta  Ta83  1  0.392884  0.667190  0.428481  1
  Ta  Ta84  1  0.386831  0.127226  0.383791  1
  Ta  Ta85  1  0.158742  0.858604  0.361206  1
  Ta  Ta86  1  0.163410  0.398385  0.406212  1
  Ta  Ta87  1  0.846307  0.429773  0.406455  1
  Ta  Ta88  1  0.856803  0.962450  0.455294  1
  Ta  Ta89  1  0.027869  0.441418  0.451295  1
  Ta  Ta90  1  1.024450  -0.012470  0.497663  1
  Ta  Ta91  1  0.524199  0.711337  0.474377  1
  Ta  Ta92  1  0.524581  0.264109  0.520625  1
  Ta  Ta93  1  0.278655  0.579685  0.535730  1
  Ta  Ta94  1  0.334477  0.009975  0.490794  1
  Ta  Ta95  1  0.717226  0.967954  0.504510  1
  Ta  Ta96  1  0.781055  0.396353  0.459892  1
  Ta  Ta97  1  0.351222  0.592402  0.483065  1
  Ta  Ta98  1  0.355469  0.142914  0.527611  1
  Ta  Ta99  1  0.694856  0.833840  0.468170  1
  Ta  Ta100  1  0.695962  0.383193  0.513840  1
  Ta  Ta101  1  0.849789  0.657822  0.535310  1
  Ta  Ta102  1  0.854825  0.108544  0.490702  1
  Ta  Ta103  1  0.196472  0.868641  0.504582  1
  Ta  Ta104  1  0.208868  0.328578  0.461197  1
  Ta  Ta105  1  0.777973  0.672551  0.482896  1
  Ta  Ta106  1  0.834629  0.241853  0.527229  1
  Ta  Ta107  1  0.214329  0.735583  0.468909  1
  Ta  Ta108  1  0.219140  0.283625  0.513937  1
  Ta  Ta109  1  0.490292  0.890226  0.508862  1
  Ta  Ta110  1  0.529804  0.356548  0.460134  1
  Ta  Ta111  1  0.538994  0.626660  0.533006  1
  Ta  Ta112  1  0.559259  0.089931  0.486579  1
  Ta  Ta113  1  0.389296  0.857521  0.459095  1
  Ta  Ta114  1  0.395863  0.408897  0.504709  1
  Ta  Ta115  1  0.596531  0.522659  0.491225  1
  Ta  Ta116  1  0.661178  0.120264  0.536514  1
  Ta  Ta117  1  0.893415  0.843004  0.513731  1
  Ta  Ta118  1  0.968851  0.247270  0.470094  1
  Ta  Ta119  1  0.094961  0.729888  0.527067  1
  Ta  Ta120  1  0.161541  0.131359  0.481641  1
  Ta  Ta121  1  0.975094  0.809001  0.464003  1
  Ta  Ta122  1  0.992342  0.361437  0.509729  1
  Ta  Ta123  1  0.039299  0.624297  0.485861  1
  Ta  Ta124  1  0.059657  0.161065  0.531522  1
  Ta  Ta125  1  0.662974  0.773198  0.523229  1
  Ta  Ta126  1  0.693414  0.236604  0.478203  1
  Ta  Ta127  1  0.363627  0.742622  0.517538  1
  Ta  Ta128  1  0.390326  0.214769  0.473906  1
  Ta  Ta129  1  0.157859  0.938207  0.451444  1
  Ta  Ta130  1  0.164999  0.478103  0.495466  1
  Ta  Ta131  1  0.863909  0.508428  0.501203  1
  Ta  Ta132  1  0.889633  0.036730  0.544254  1
  Ta  Ta133  1  1.025039  0.539835  0.544107  1
  Ta  Ta134  1  0.025645  0.080422  0.589018  1
  Ta  Ta135  1  0.527098  0.809776  0.567721  1
  Ta  Ta136  1  0.527302  0.352785  0.612047  1
  Ta  Ta137  1  0.278272  0.663795  0.630510  1
  Ta  Ta138  1  0.273026  0.127026  0.581503  1
  Ta  Ta139  1  0.704098  0.052318  0.592638  1
  Ta  Ta140  1  0.714321  0.515374  0.549954  1
  Ta  Ta141  1  0.349941  0.692088  0.574064  1
  Ta  Ta142  1  0.341993  0.238499  0.621380  1
  Ta  Ta143  1  0.707463  0.922984  0.557190  1
  Ta  Ta144  1  0.707151  0.467890  0.602137  1
  Ta  Ta145  1  0.848741  0.735893  0.623768  1
  Ta  Ta146  1  0.843222  0.194547  0.579226  1
  Ta  Ta147  1  0.210265  0.967137  0.597628  1
  Ta  Ta148  1  0.197250  0.418076  0.550394  1
  Ta  Ta149  1  0.849745  0.782828  0.571049  1
  Ta  Ta150  1  0.847624  0.324321  0.614320  1
  Ta  Ta151  1  0.281127  0.854169  0.558806  1
  Ta  Ta152  1  0.279380  0.395948  0.605961  1
  Ta  Ta153  1  0.469199  0.968569  0.601288  1
  Ta  Ta154  1  0.475442  0.443832  0.554776  1
  Ta  Ta155  1  0.527006  0.708713  0.626805  1
  Ta  Ta156  1  0.523716  0.167941  0.580464  1
  Ta  Ta157  1  0.468476  0.004204  0.548657  1
  Ta  Ta158  1  0.470378  0.552716  0.594572  1
  Ta  Ta159  1  0.662385  0.665856  0.581380  1
  Ta  Ta160  1  0.665031  0.207576  0.625427  1
  Ta  Ta161  1  0.890428  0.937268  0.603499  1
  Ta  Ta162  1  0.890551  0.393815  0.559347  1
  Ta  Ta163  1  0.082048  0.824829  0.613577  1
  Ta  Ta164  1  0.084723  0.277037  0.570663  1
  Ta  Ta165  1  0.029480  0.894936  0.557766  1
  Ta  Ta166  1  0.028576  0.438229  0.603512  1
  Ta  Ta167  1  0.088857  0.700032  0.579532  1
  Ta  Ta168  1  0.080600  0.236248  0.622649  1
  Ta  Ta169  1  0.663656  0.852452  0.612484  1
  Ta  Ta170  1  0.658851  0.313487  0.566746  1
  Ta  Ta171  1  0.342110  0.820574  0.613633  1
  Ta  Ta172  1  0.359387  0.289980  0.563363  1
  Ta  Ta173  1  0.194919  0.014456  0.539945  1
  Ta  Ta174  1  0.207612  0.550906  0.589072  1
  Ta  Ta175  1  0.893025  0.583410  0.589995  1
  Ta  Ta176  1  0.889838  0.121298  0.634428  1
  Ta  Ta177  1  0.028198  0.620924  0.635350  1
  Ta  Ta178  1  0.029361  0.162616  0.677919  1
  Ta  Ta179  1  0.529407  0.893517  0.657487  1
  Ta  Ta180  1  0.533621  0.435709  0.701613  1
  Ta  Ta181  1  0.270779  0.759521  0.719235  1
  Ta  Ta182  1  0.276060  0.204971  0.676144  1
  Ta  Ta183  1  0.712814  0.131856  0.683979  1
  Ta  Ta184  1  0.706991  0.595586  0.638613  1
  Ta  Ta185  1  0.355659  0.777076  0.670479  1
  Ta  Ta186  1  0.374806  0.309514  0.714512  1
  Ta  Ta187  1  0.706490  0.008682  0.646507  1
  Ta  Ta188  1  0.717216  0.548888  0.690210  1
  Ta  Ta189  1  0.851191  0.817913  0.709112  1
  Ta  Ta190  1  0.847828  0.275227  0.666990  1
  Ta  Ta191  1  0.195288  0.043684  0.694809  1
  Ta  Ta192  1  0.212707  0.508356  0.647335  1
  Ta  Ta193  1  0.849534  0.866008  0.659178  1
  Ta  Ta194  1  0.845991  0.396350  0.703766  1
  Ta  Ta195  1  0.279369  0.935522  0.653693  1
  Ta  Ta196  1  0.276782  0.470975  0.700241  1
  Ta  Ta197  1  0.459894  0.058961  0.686107  1
  Ta  Ta198  1  0.475209  0.509909  0.646880  1
  Ta  Ta199  1  0.536778  0.788913  0.713923  1
  Ta  Ta200  1  0.529249  0.246724  0.669786  1
  Ta  Ta201  1  0.473291  0.093946  0.635152  1
  Ta  Ta202  1  0.459587  0.626145  0.684603  1
  Ta  Ta203  1  0.669336  0.745937  0.671369  1
  Ta  Ta204  1  0.653765  0.287816  0.714126  1
  Ta  Ta205  1  0.902218  0.016655  0.695080  1
  Ta  Ta206  1  0.890792  0.478107  0.648961  1
  Ta  Ta207  1  0.099201  0.888201  0.701982  1
  Ta  Ta208  1  0.085614  0.360831  0.657280  1
  Ta  Ta209  1  0.029336  0.979192  0.648714  1
  Ta  Ta210  1  1.024118  0.511561  0.693370  1
  Ta  Ta211  1  0.090585  0.778048  0.664011  1
  Ta  Ta212  1  0.104332  0.319055  0.707325  1
  Ta  Ta213  1  0.665951  0.937145  0.700762  1
  Ta  Ta214  1  0.665660  0.393522  0.657281  1
  Ta  Ta215  1  0.368946  0.914193  0.707872  1
  Ta  Ta216  1  0.350196  0.363915  0.661586  1
  Ta  Ta217  1  0.212795  0.092026  0.637289  1
  Ta  Ta218  1  0.194462  0.635950  0.685917  1
  Ta  Ta219  1  0.900745  0.668348  0.680618  1
  Ta  Ta220  1  0.885203  0.215185  0.718432  1
