# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.68320392
_cell_length_b   26.16925476
_cell_length_c   57.91925668
_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   Ta198
_cell_volume   7098.34990045
_cell_formula_units_Z   198
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  1.010010  0.715561  0.322733  1
  Ta  Ta2  1  1.010010  0.440268  0.379986  1
  Ta  Ta3  1  1.010010  -0.004657  0.267955  1
  Ta  Ta4  1  0.510010  0.939411  0.377338  1
  Ta  Ta5  1  0.510010  0.462259  0.272979  1
  Ta  Ta6  1  0.510010  0.222635  0.321178  1
  Ta  Ta7  1  1.010010  0.092325  0.398149  1
  Ta  Ta8  1  1.010010  0.646451  0.288724  1
  Ta  Ta9  1  1.010010  0.371485  0.343671  1
  Ta  Ta10  1  1.010010  0.784421  0.375863  1
  Ta  Ta11  1  1.010010  0.370088  0.268123  1
  Ta  Ta12  1  1.010010  0.072469  0.317323  1
  Ta  Ta13  1  0.510010  0.036995  0.393616  1
  Ta  Ta14  1  0.510010  0.589663  0.286053  1
  Ta  Ta15  1  0.510010  0.317179  0.338360  1
  Ta  Ta16  1  0.510010  0.838177  0.364954  1
  Ta  Ta17  1  0.510010  0.562699  0.419362  1
  Ta  Ta18  1  0.510010  0.124017  0.312275  1
  Ta  Ta19  1  1.010010  0.970868  0.311518  1
  Ta  Ta20  1  1.010010  0.676288  0.366708  1
  Ta  Ta21  1  1.010010  0.399158  0.422946  1
  Ta  Ta22  1  1.010010  0.769691  0.282388  1
  Ta  Ta23  1  1.010010  0.490584  0.340251  1
  Ta  Ta24  1  1.010010  0.201455  0.391278  1
  Ta  Ta25  1  0.510010  0.896954  0.323893  1
  Ta  Ta26  1  0.510010  0.625984  0.378937  1
  Ta  Ta27  1  0.510010  0.168133  0.271833  1
  Ta  Ta28  1  0.510010  0.832655  0.270028  1
  Ta  Ta29  1  0.510010  0.510085  0.314335  1
  Ta  Ta30  1  0.510010  0.232598  0.369700  1
  Ta  Ta31  1  1.010010  0.876480  0.401696  1
  Ta  Ta32  1  1.010010  0.432828  0.303462  1
  Ta  Ta33  1  1.010010  0.157478  0.346640  1
  Ta  Ta34  1  1.010010  0.026865  0.360179  1
  Ta  Ta35  1  1.010010  0.746943  0.419032  1
  Ta  Ta36  1  1.010010  0.306694  0.305102  1
  Ta  Ta37  1  0.510010  0.831078  0.415335  1
  Ta  Ta38  1  0.510010  0.378774  0.300988  1
  Ta  Ta39  1  0.510010  0.109694  0.359147  1
  Ta  Ta40  1  0.510010  0.004741  0.333702  1
  Ta  Ta41  1  0.510010  0.724960  0.395733  1
  Ta  Ta42  1  0.510010  0.281517  0.281798  1
  Ta  Ta43  1  1.010010  0.819040  0.331762  1
  Ta  Ta44  1  1.010010  0.552063  0.384690  1
  Ta  Ta45  1  1.010010  0.104152  0.274139  1
  Ta  Ta46  1  1.010010  0.876877  0.291729  1
  Ta  Ta47  1  1.010010  0.589156  0.330730  1
  Ta  Ta48  1  1.010010  0.308704  0.392292  1
  Ta  Ta49  1  0.510010  0.798111  0.311098  1
  Ta  Ta50  1  0.510010  0.529453  0.361337  1
  Ta  Ta51  1  0.510010  0.247654  0.417160  1
  Ta  Ta52  1  0.510010  0.939141  0.282129  1
  Ta  Ta53  1  0.510010  0.640967  0.327654  1
  Ta  Ta54  1  0.510010  0.360207  0.383842  1
  Ta  Ta55  1  1.010010  0.914677  0.353001  1
  Ta  Ta56  1  1.010010  0.638125  0.412253  1
  Ta  Ta57  1  1.010010  0.197741  0.297722  1
  Ta  Ta58  1  1.010010  0.981137  0.402529  1
  Ta  Ta59  1  1.010010  0.530806  0.287670  1
  Ta  Ta60  1  1.010010  0.261563  0.347045  1
  Ta  Ta61  1  0.510010  0.708499  0.289643  1
  Ta  Ta62  1  0.510010  0.428972  0.345327  1
  Ta  Ta63  1  0.510010  0.148526  0.404276  1
  Ta  Ta64  1  0.510010  0.736126  0.348374  1
  Ta  Ta65  1  0.510010  0.463461  0.402238  1
  Ta  Ta66  1  0.510010  0.042912  0.285268  1
  Ta  Ta67  1  1.010010  0.882673  0.491372  1
  Ta  Ta68  1  1.010010  0.601248  0.547549  1
  Ta  Ta69  1  1.010010  0.160347  0.434867  1
  Ta  Ta70  1  0.510010  0.101268  0.547115  1
  Ta  Ta71  1  0.510010  0.660322  0.435771  1
  Ta  Ta72  1  0.510010  0.380759  0.490544  1
  Ta  Ta73  1  1.010010  0.255612  0.565533  1
  Ta  Ta74  1  1.010010  0.814128  0.455419  1
  Ta  Ta75  1  1.010010  0.534649  0.510403  1
  Ta  Ta76  1  1.010010  0.950880  0.541672  1
  Ta  Ta77  1  1.010010  0.509030  0.429662  1
  Ta  Ta78  1  1.010010  0.228926  0.485344  1
  Ta  Ta79  1  0.510010  0.200116  0.559877  1
  Ta  Ta80  1  0.510010  0.758893  0.450662  1
  Ta  Ta81  1  0.510010  0.479329  0.504962  1
  Ta  Ta82  1  0.510010  0.004061  0.530771  1
  Ta  Ta83  1  0.510010  0.724174  0.587168  1
  Ta  Ta84  1  0.510010  0.282579  0.474571  1
  Ta  Ta85  1  1.010010  0.119027  0.478524  1
  Ta  Ta86  1  1.010010  0.840978  0.535147  1
  Ta  Ta87  1  1.010010  0.560436  0.591109  1
  Ta  Ta88  1  1.010010  0.921246  0.446871  1
  Ta  Ta89  1  1.010010  0.644602  0.504824  1
  Ta  Ta90  1  1.010010  0.365325  0.559664  1
  Ta  Ta91  1  0.510010  0.066031  0.489419  1
  Ta  Ta92  1  0.510010  0.787072  0.546060  1
  Ta  Ta93  1  0.510010  0.345381  0.433436  1
  Ta  Ta94  1  0.510010  0.952860  0.425428  1
  Ta  Ta95  1  0.510010  0.674224  0.483062  1
  Ta  Ta96  1  0.510010  0.395190  0.537945  1
  Ta  Ta97  1  1.010010  0.041191  0.572223  1
  Ta  Ta98  1  1.010010  0.598285  0.459810  1
  Ta  Ta99  1  1.010010  0.319114  0.514947  1
  Ta  Ta100  1  1.010010  0.187759  0.529094  1
  Ta  Ta101  1  1.010010  0.909363  0.585387  1
  Ta  Ta102  1  1.010010  0.467921  0.473272  1
  Ta  Ta103  1  0.510010  -0.008700  0.580541  1
  Ta  Ta104  1  0.510010  0.549776  0.469493  1
  Ta  Ta105  1  0.510010  0.270355  0.524547  1
  Ta  Ta106  1  0.510010  0.166070  0.505759  1
  Ta  Ta107  1  0.510010  0.887494  0.562060  1
  Ta  Ta108  1  0.510010  0.445994  0.449921  1
  Ta  Ta109  1  1.010010  -0.008814  0.496365  1
  Ta  Ta110  1  1.010010  0.711556  0.553288  1
  Ta  Ta111  1  1.010010  0.269843  0.440382  1
  Ta  Ta112  1  1.010010  0.028314  0.447516  1
  Ta  Ta113  1  1.010010  0.750610  0.505803  1
  Ta  Ta114  1  1.010010  0.471023  0.561383  1
  Ta  Ta115  1  0.510010  0.968941  0.472948  1
  Ta  Ta116  1  0.510010  0.688591  0.530346  1
  Ta  Ta117  1  0.510010  0.408910  0.585414  1
  Ta  Ta118  1  0.510010  0.078752  0.439784  1
  Ta  Ta119  1  0.510010  0.799712  0.496368  1
  Ta  Ta120  1  0.510010  0.519161  0.551175  1
  Ta  Ta121  1  1.010010  0.078891  0.523717  1
  Ta  Ta122  1  1.010010  0.799948  0.580095  1
  Ta  Ta123  1  1.010010  0.357961  0.467442  1
  Ta  Ta124  1  1.010010  0.147780  0.573099  1
  Ta  Ta125  1  1.010010  0.703981  0.461431  1
  Ta  Ta126  1  1.010010  0.425171  0.516253  1
  Ta  Ta127  1  0.510010  0.869799  0.461064  1
  Ta  Ta128  1  0.510010  0.589965  0.515712  1
  Ta  Ta129  1  0.510010  0.310749  0.570534  1
  Ta  Ta130  1  0.510010  0.904152  0.514631  1
  Ta  Ta131  1  0.510010  0.623333  0.570797  1
  Ta  Ta132  1  0.510010  0.182292  0.458264  1
  Ta  Ta133  1  1.010010  0.042765  0.659741  1
  Ta  Ta134  1  1.010010  0.763595  0.715466  1
  Ta  Ta135  1  1.010010  0.322406  0.602368  1
  Ta  Ta136  1  0.510010  0.261105  0.716452  1
  Ta  Ta137  1  0.510010  0.822007  0.603266  1
  Ta  Ta138  1  0.510010  0.540454  0.659162  1
  Ta  Ta139  1  1.010010  0.423711  0.731212  1
  Ta  Ta140  1  1.010010  0.977340  0.621954  1
  Ta  Ta141  1  1.010010  0.698564  0.676928  1
  Ta  Ta142  1  1.010010  0.098600  0.707664  1
  Ta  Ta143  1  1.010010  0.670402  0.597687  1
  Ta  Ta144  1  1.010010  0.392043  0.654308  1
  Ta  Ta145  1  0.510010  0.363211  0.728318  1
  Ta  Ta146  1  0.510010  0.921163  0.615830  1
  Ta  Ta147  1  0.510010  0.641091  0.675247  1
  Ta  Ta148  1  0.510010  0.170333  0.693819  1
  Ta  Ta149  1  0.510010  0.902881  0.748583  1
  Ta  Ta150  1  0.510010  0.443311  0.642028  1
  Ta  Ta151  1  1.010010  0.284387  0.645757  1
  Ta  Ta152  1  1.010010  -0.002734  0.702698  1
  Ta  Ta153  1  1.010010  0.700110  0.752411  1
  Ta  Ta154  1  1.010010  0.088190  0.617333  1
  Ta  Ta155  1  1.010010  0.808113  0.673368  1
  Ta  Ta156  1  1.010010  0.539185  0.732747  1
  Ta  Ta157  1  0.510010  0.231384  0.655630  1
  Ta  Ta158  1  0.510010  0.946262  0.708069  1
  Ta  Ta159  1  0.510010  0.506711  0.601512  1
  Ta  Ta160  1  0.510010  0.116571  0.594622  1
  Ta  Ta161  1  0.510010  0.837076  0.650716  1
  Ta  Ta162  1  0.510010  0.560203  0.706099  1
  Ta  Ta163  1  1.010010  0.190662  0.727769  1
  Ta  Ta164  1  1.010010  0.761129  0.628079  1
  Ta  Ta165  1  1.010010  0.480382  0.689469  1
  Ta  Ta166  1  1.010010  0.352684  0.698171  1
  Ta  Ta167  1  1.010010  0.076665  0.751468  1
  Ta  Ta168  1  1.010010  0.629709  0.640640  1
  Ta  Ta169  1  0.510010  0.133609  0.736291  1
  Ta  Ta170  1  0.510010  0.709885  0.636825  1
  Ta  Ta171  1  0.510010  0.428947  0.691714  1
  Ta  Ta172  1  0.510010  0.328598  0.674863  1
  Ta  Ta173  1  0.510010  0.028664  0.734519  1
  Ta  Ta174  1  0.510010  0.606278  0.618441  1
  Ta  Ta175  1  1.010010  0.156640  0.666875  1
  Ta  Ta176  1  1.010010  0.872743  0.722768  1
  Ta  Ta177  1  1.010010  0.430875  0.608878  1
  Ta  Ta178  1  1.010010  0.193140  0.618076  1
  Ta  Ta179  1  1.010010  0.912074  0.673810  1
  Ta  Ta180  1  1.010010  0.637336  0.717067  1
  Ta  Ta181  1  0.510010  0.130691  0.642359  1
  Ta  Ta182  1  0.510010  0.847572  0.699294  1
  Ta  Ta183  1  0.510010  0.607671  0.747488  1
  Ta  Ta184  1  0.510010  0.239091  0.605692  1
  Ta  Ta185  1  0.510010  0.959348  0.661003  1
  Ta  Ta186  1  0.510010  0.691414  0.719689  1
  Ta  Ta187  1  1.010010  0.250742  0.690071  1
  Ta  Ta188  1  1.010010  0.967178  0.746059  1
  Ta  Ta189  1  1.010010  0.517613  0.635934  1
  Ta  Ta190  1  1.010010  0.302057  0.738067  1
  Ta  Ta191  1  1.010010  0.868534  0.629152  1
  Ta  Ta192  1  1.010010  0.579292  0.680318  1
  Ta  Ta193  1  0.510010  0.032637  0.626877  1
  Ta  Ta194  1  0.510010  0.752836  0.682356  1
  Ta  Ta195  1  0.510010  0.480014  0.733728  1
  Ta  Ta196  1  0.510010  0.064222  0.685976  1
  Ta  Ta197  1  0.510010  0.788940  0.738748  1
  Ta  Ta198  1  0.510010  0.343746  0.626183  1
