# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.51424288
_cell_length_b   16.46580547
_cell_length_c   49.96905349
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.93545924
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta220
_cell_volume   8650.9107807
_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  0.269949  0.400956  0.363563  1
  Ta  Ta2  1  0.278891  0.853839  0.317023  1
  Ta  Ta3  1  0.756224  0.582685  0.296767  1
  Ta  Ta4  1  0.764246  0.128059  0.340700  1
  Ta  Ta5  1  0.587378  0.426639  0.361410  1
  Ta  Ta6  1  0.581473  0.892502  0.315680  1
  Ta  Ta7  1  0.024441  0.265539  0.278177  1
  Ta  Ta8  1  0.029015  0.811361  0.320324  1
  Ta  Ta9  1  0.581706  0.466198  0.309684  1
  Ta  Ta10  1  0.587465  0.015285  0.352568  1
  Ta  Ta11  1  0.913939  0.709635  0.280934  1
  Ta  Ta12  1  0.934637  0.242584  0.326386  1
  Ta  Ta13  1  0.098162  0.515620  0.349047  1
  Ta  Ta14  1  0.110285  0.976117  0.301899  1
  Ta  Ta15  1  0.449872  0.744185  0.330665  1
  Ta  Ta16  1  0.443770  0.201305  0.288307  1
  Ta  Ta17  1  1.014509  0.543470  0.297888  1
  Ta  Ta18  1  1.013472  0.083679  0.343324  1
  Ta  Ta19  1  0.455314  0.616618  0.296329  1
  Ta  Ta20  1  0.445541  0.158305  0.339177  1
  Ta  Ta21  1  0.767439  0.776307  0.327916  1
  Ta  Ta22  1  0.746246  0.233184  0.283904  1
  Ta  Ta23  1  0.827056  0.509934  0.351622  1
  Ta  Ta24  1  0.841341  0.958229  0.313543  1
  Ta  Ta25  1  0.632352  0.733857  0.285910  1
  Ta  Ta26  1  0.628051  0.274974  0.327913  1
  Ta  Ta27  1  0.838483  0.394098  0.313150  1
  Ta  Ta28  1  0.823555  0.933766  0.363896  1
  Ta  Ta29  1  0.216526  0.661079  0.340212  1
  Ta  Ta30  1  0.190621  0.135169  0.297753  1
  Ta  Ta31  1  0.408665  0.542997  0.349846  1
  Ta  Ta32  1  0.393840  0.013462  0.304822  1
  Ta  Ta33  1  0.189090  0.687457  0.290942  1
  Ta  Ta34  1  0.201260  0.241176  0.334883  1
  Ta  Ta35  1  0.277424  0.506058  0.305329  1
  Ta  Ta36  1  0.265605  0.045628  0.349423  1
  Ta  Ta37  1  0.940735  0.656133  0.334296  1
  Ta  Ta38  1  0.919095  0.105024  0.289618  1
  Ta  Ta39  1  0.632565  0.628347  0.341144  1
  Ta  Ta40  1  0.634677  0.079151  0.298021  1
  Ta  Ta41  1  0.395909  0.349760  0.319488  1
  Ta  Ta42  1  0.403168  0.901452  0.362744  1
  Ta  Ta43  1  0.110259  0.382239  0.312609  1
  Ta  Ta44  1  0.094810  0.925924  0.357049  1
  Ta  Ta45  1  0.269255  0.479402  0.454752  1
  Ta  Ta46  1  0.268690  0.939718  0.408456  1
  Ta  Ta47  1  0.767624  0.669337  0.385899  1
  Ta  Ta48  1  0.765852  0.210471  0.432159  1
  Ta  Ta49  1  0.586955  0.509520  0.451469  1
  Ta  Ta50  1  0.587804  0.969132  0.406608  1
  Ta  Ta51  1  0.017222  0.358077  0.365949  1
  Ta  Ta52  1  0.017390  0.896863  0.412714  1
  Ta  Ta53  1  0.590436  0.555335  0.397746  1
  Ta  Ta54  1  0.588619  0.096603  0.443498  1
  Ta  Ta55  1  0.938880  0.786855  0.373116  1
  Ta  Ta56  1  0.936702  0.327522  0.419416  1
  Ta  Ta57  1  0.100502  0.597828  0.441973  1
  Ta  Ta58  1  0.094311  0.055336  0.396624  1
  Ta  Ta59  1  0.446947  0.826504  0.420250  1
  Ta  Ta60  1  0.444579  0.285469  0.375744  1
  Ta  Ta61  1  0.018460  0.626831  0.389037  1
  Ta  Ta62  1  0.017290  0.167814  0.436142  1
  Ta  Ta63  1  0.448455  0.698567  0.383778  1
  Ta  Ta64  1  0.447141  0.239146  0.429521  1
  Ta  Ta65  1  0.764670  0.854738  0.417951  1
  Ta  Ta66  1  0.768631  0.316567  0.370903  1
  Ta  Ta67  1  0.829269  0.590087  0.444700  1
  Ta  Ta68  1  0.824727  0.054725  0.399090  1
  Ta  Ta69  1  0.628381  0.816419  0.371831  1
  Ta  Ta70  1  0.631568  0.355164  0.417391  1
  Ta  Ta71  1  0.828940  0.475116  0.405426  1
  Ta  Ta72  1  0.829309  0.015143  0.451767  1
  Ta  Ta73  1  0.206158  0.744572  0.427534  1
  Ta  Ta74  1  0.208938  0.202227  0.385613  1
  Ta  Ta75  1  0.404707  0.626048  0.439819  1
  Ta  Ta76  1  0.405157  0.084718  0.395089  1
  Ta  Ta77  1  0.210608  0.783950  0.374568  1
  Ta  Ta78  1  0.207369  0.322293  0.421571  1
  Ta  Ta79  1  0.270491  0.584183  0.394568  1
  Ta  Ta80  1  0.269710  0.125333  0.440806  1
  Ta  Ta81  1  0.934242  0.736131  0.428607  1
  Ta  Ta82  1  0.940288  0.197752  0.381976  1
  Ta  Ta83  1  0.630938  0.709082  0.431918  1
  Ta  Ta84  1  0.630571  0.171157  0.386526  1
  Ta  Ta85  1  0.405553  0.439264  0.409440  1
  Ta  Ta86  1  0.405798  0.979651  0.454717  1
  Ta  Ta87  1  0.098890  0.466701  0.405495  1
  Ta  Ta88  1  0.099767  0.007198  0.451892  1
  Ta  Ta89  1  0.268970  0.563909  0.545087  1
  Ta  Ta90  1  0.271286  0.020529  0.500287  1
  Ta  Ta91  1  0.765741  0.748018  0.477837  1
  Ta  Ta92  1  0.762172  0.290016  0.523780  1
  Ta  Ta93  1  0.585998  0.588857  0.542091  1
  Ta  Ta94  1  0.586793  0.051430  0.497327  1
  Ta  Ta95  1  0.017178  0.437882  0.458732  1
  Ta  Ta96  1  0.018439  0.978482  0.505053  1
  Ta  Ta97  1  0.582936  0.635719  0.487857  1
  Ta  Ta98  1  0.587044  0.176766  0.535121  1
  Ta  Ta99  1  0.936412  0.867968  0.466007  1
  Ta  Ta100  1  0.931628  0.409324  0.511304  1
  Ta  Ta101  1  0.101297  0.680952  0.532754  1
  Ta  Ta102  1  0.097927  0.138582  0.489126  1
  Ta  Ta103  1  0.450294  0.907165  0.512062  1
  Ta  Ta104  1  0.446298  0.365901  0.466063  1
  Ta  Ta105  1  0.019711  0.709095  0.480814  1
  Ta  Ta106  1  1.015091  0.249413  0.528150  1
  Ta  Ta107  1  0.447860  0.780940  0.474264  1
  Ta  Ta108  1  0.446910  0.319434  0.520159  1
  Ta  Ta109  1  0.765426  0.939397  0.509087  1
  Ta  Ta110  1  0.765713  0.397990  0.462856  1
  Ta  Ta111  1  0.837154  0.672531  0.544295  1
  Ta  Ta112  1  0.826430  0.131946  0.490086  1
  Ta  Ta113  1  0.631667  0.896002  0.463438  1
  Ta  Ta114  1  0.627718  0.436989  0.507680  1
  Ta  Ta115  1  0.828452  0.561794  0.499442  1
  Ta  Ta116  1  0.833627  0.098700  0.543988  1
  Ta  Ta117  1  0.204270  0.828379  0.518344  1
  Ta  Ta118  1  0.205261  0.285383  0.474673  1
  Ta  Ta119  1  0.404441  0.710183  0.530664  1
  Ta  Ta120  1  0.403758  0.167248  0.486299  1
  Ta  Ta121  1  0.209455  0.861715  0.465471  1
  Ta  Ta122  1  0.205350  0.401183  0.513227  1
  Ta  Ta123  1  0.270319  0.666969  0.485088  1
  Ta  Ta124  1  0.266615  0.209560  0.532070  1
  Ta  Ta125  1  0.927167  0.816200  0.520174  1
  Ta  Ta126  1  0.933566  0.278108  0.475011  1
  Ta  Ta127  1  0.633002  0.787276  0.522742  1
  Ta  Ta128  1  0.630005  0.250486  0.477838  1
  Ta  Ta129  1  0.402546  0.519589  0.500053  1
  Ta  Ta130  1  0.404046  0.063708  0.546404  1
  Ta  Ta131  1  0.099827  0.547249  0.497002  1
  Ta  Ta132  1  0.103966  0.088224  0.544237  1
  Ta  Ta133  1  0.261521  0.646405  0.636845  1
  Ta  Ta134  1  0.268458  0.100435  0.592743  1
  Ta  Ta135  1  0.757203  0.846213  0.566995  1
  Ta  Ta136  1  0.759408  0.392315  0.612648  1
  Ta  Ta137  1  0.584740  0.673820  0.632305  1
  Ta  Ta138  1  0.584864  0.130324  0.589803  1
  Ta  Ta139  1  0.017550  0.515330  0.550464  1
  Ta  Ta140  1  1.014532  0.057002  0.598546  1
  Ta  Ta141  1  0.595177  0.716381  0.578310  1
  Ta  Ta142  1  0.593958  0.258991  0.625806  1
  Ta  Ta143  1  0.940259  0.954073  0.558540  1
  Ta  Ta144  1  0.995815  0.471842  0.605476  1
  Ta  Ta145  1  0.092639  0.763923  0.626948  1
  Ta  Ta146  1  0.090173  0.216408  0.581101  1
  Ta  Ta147  1  0.451711  0.985039  0.603698  1
  Ta  Ta148  1  0.438600  0.445436  0.556428  1
  Ta  Ta149  1  0.028074  0.803998  0.570938  1
  Ta  Ta150  1  0.992893  0.314320  0.622129  1
  Ta  Ta151  1  0.455382  0.860315  0.566316  1
  Ta  Ta152  1  0.438265  0.388502  0.612518  1
  Ta  Ta153  1  0.761929  0.014766  0.602078  1
  Ta  Ta154  1  0.755564  0.468901  0.553534  1
  Ta  Ta155  1  0.840306  0.723637  0.604850  1
  Ta  Ta156  1  0.817403  0.212415  0.582802  1
  Ta  Ta157  1  0.629475  0.985744  0.553874  1
  Ta  Ta158  1  0.578319  0.515454  0.599344  1
  Ta  Ta159  1  0.807401  0.575949  0.591233  1
  Ta  Ta160  1  0.821598  0.166230  0.636608  1
  Ta  Ta161  1  0.196633  0.909011  0.610914  1
  Ta  Ta162  1  0.194562  0.367381  0.568327  1
  Ta  Ta163  1  0.400112  0.792220  0.622757  1
  Ta  Ta164  1  0.397488  0.245320  0.577833  1
  Ta  Ta165  1  0.220279  0.944808  0.557373  1
  Ta  Ta166  1  0.250375  0.499045  0.601289  1
  Ta  Ta167  1  0.264732  0.755299  0.576268  1
  Ta  Ta168  1  0.253788  0.284355  0.623973  1
  Ta  Ta169  1  0.915504  0.888076  0.615857  1
  Ta  Ta170  1  0.924284  0.356282  0.567180  1
  Ta  Ta171  1  0.639918  0.857334  0.617756  1
  Ta  Ta172  1  0.621375  0.328104  0.569444  1
  Ta  Ta173  1  0.397387  0.623673  0.588950  1
  Ta  Ta174  1  0.405874  0.145988  0.638080  1
  Ta  Ta175  1  0.082039  0.634677  0.587303  1
  Ta  Ta176  1  0.096213  0.164091  0.638643  1
  Ta  Ta177  1  0.278664  0.724131  0.723879  1
  Ta  Ta178  1  0.261736  0.183999  0.682744  1
  Ta  Ta179  1  0.756677  0.921966  0.663024  1
  Ta  Ta180  1  0.752929  0.464813  0.702728  1
  Ta  Ta181  1  0.555958  0.763118  0.725802  1
  Ta  Ta182  1  0.582030  0.215672  0.679727  1
  Ta  Ta183  1  1.013109  0.599794  0.641226  1
  Ta  Ta184  1  0.995839  0.148920  0.691291  1
  Ta  Ta185  1  0.570504  0.802732  0.673647  1
  Ta  Ta186  1  0.577534  0.348777  0.712476  1
  Ta  Ta187  1  0.942470  0.029604  0.653749  1
  Ta  Ta188  1  0.910923  0.600328  0.695122  1
  Ta  Ta189  1  0.100523  0.850888  0.720309  1
  Ta  Ta190  1  0.086485  0.304424  0.675762  1
  Ta  Ta191  1  0.447489  0.067717  0.694706  1
  Ta  Ta192  1  0.440674  0.533467  0.647935  1
  Ta  Ta193  1  0.022541  0.879598  0.667696  1
  Ta  Ta194  1  0.016518  0.426628  0.710760  1
  Ta  Ta195  1  0.448423  0.942823  0.658228  1
  Ta  Ta196  1  0.460923  0.501095  0.699290  1
  Ta  Ta197  1  0.749422  0.102370  0.693942  1
  Ta  Ta198  1  0.754875  0.556205  0.645565  1
  Ta  Ta199  1  0.825954  0.794175  0.706314  1
  Ta  Ta200  1  0.808660  0.299519  0.668466  1
  Ta  Ta201  1  0.625210  0.059178  0.647552  1
  Ta  Ta202  1  0.647587  0.634224  0.689671  1
  Ta  Ta203  1  0.830637  0.740145  0.656577  1
  Ta  Ta204  1  0.842538  0.281044  0.717645  1
  Ta  Ta205  1  0.178726  0.003453  0.697378  1
  Ta  Ta206  1  0.197329  0.444695  0.652959  1
  Ta  Ta207  1  0.379534  0.886676  0.712821  1
  Ta  Ta208  1  0.397126  0.330236  0.668072  1
  Ta  Ta209  1  0.225417  0.024445  0.647690  1
  Ta  Ta210  1  0.194405  0.560928  0.690879  1
  Ta  Ta211  1  0.265098  0.830700  0.669324  1
  Ta  Ta212  1  0.276017  0.384451  0.710629  1
  Ta  Ta213  1  0.909114  0.973508  0.709567  1
  Ta  Ta214  1  0.928970  0.445914  0.661070  1
  Ta  Ta215  1  0.630302  0.940747  0.708287  1
  Ta  Ta216  1  0.619513  0.412818  0.658907  1
  Ta  Ta217  1  0.398489  0.682386  0.680645  1
  Ta  Ta218  1  0.398487  0.232244  0.723736  1
  Ta  Ta219  1  0.088755  0.716509  0.683580  1
  Ta  Ta220  1  0.117378  0.259310  0.728826  1
