# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.46795429
_cell_length_b   16.49070603
_cell_length_c   49.93934462
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.93541812
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta220
_cell_volume   8620.72179872
_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  0.267346  0.772896  0.326430  1
  Ta  Ta2  1  0.250896  0.228443  0.283375  1
  Ta  Ta3  1  0.769764  0.502852  0.304693  1
  Ta  Ta4  1  0.762731  0.040399  0.348112  1
  Ta  Ta5  1  0.536603  0.258954  0.278490  1
  Ta  Ta6  1  0.524428  0.808594  0.319080  1
  Ta  Ta7  1  0.946336  0.741673  0.329108  1
  Ta  Ta8  1  0.937340  0.199450  0.287617  1
  Ta  Ta9  1  0.600005  0.381960  0.312563  1
  Ta  Ta10  1  0.589309  0.922672  0.355942  1
  Ta  Ta11  1  0.950810  0.612150  0.296502  1
  Ta  Ta12  1  0.941847  0.154225  0.337974  1
  Ta  Ta13  1  0.085591  0.422639  0.359539  1
  Ta  Ta14  1  0.080169  0.888477  0.314607  1
  Ta  Ta15  1  0.439775  0.652962  0.333091  1
  Ta  Ta16  1  0.421819  0.104072  0.289929  1
  Ta  Ta17  1  0.076864  0.465246  0.308189  1
  Ta  Ta18  1  0.086501  0.012551  0.350577  1
  Ta  Ta19  1  0.512462  0.541443  0.297002  1
  Ta  Ta20  1  0.512548  0.081003  0.341808  1
  Ta  Ta21  1  0.712922  0.657128  0.339546  1
  Ta  Ta22  1  0.691914  0.127517  0.297204  1
  Ta  Ta23  1  0.766674  0.399642  0.361970  1
  Ta  Ta24  1  0.774485  0.852250  0.315873  1
  Ta  Ta25  1  0.684419  0.684652  0.289985  1
  Ta  Ta26  1  0.700826  0.240838  0.332765  1
  Ta  Ta27  1  0.891086  0.348644  0.317609  1
  Ta  Ta28  1  0.901708  0.898734  0.360970  1
  Ta  Ta29  1  0.128841  0.625995  0.339552  1
  Ta  Ta30  1  0.130166  0.079246  0.296929  1
  Ta  Ta31  1  0.324297  0.507265  0.349054  1
  Ta  Ta32  1  0.336889  0.957476  0.311114  1
  Ta  Ta33  1  0.255288  0.580071  0.295974  1
  Ta  Ta34  1  0.263099  0.126662  0.339081  1
  Ta  Ta35  1  0.333939  0.389538  0.311549  1
  Ta  Ta36  1  0.321407  0.927096  0.361758  1
  Ta  Ta37  1  0.906368  0.539748  0.348271  1
  Ta  Ta38  1  0.893282  0.009362  0.303813  1
  Ta  Ta39  1  0.591817  0.512847  0.348064  1
  Ta  Ta40  1  0.604559  0.972547  0.302285  1
  Ta  Ta41  1  0.410224  0.706410  0.281294  1
  Ta  Ta42  1  0.434194  0.239859  0.325544  1
  Ta  Ta43  1  0.128005  0.727057  0.285766  1
  Ta  Ta44  1  0.121258  0.271428  0.325936  1
  Ta  Ta45  1  0.263942  0.849230  0.416244  1
  Ta  Ta46  1  0.266136  0.310678  0.369174  1
  Ta  Ta47  1  0.768205  0.579571  0.393702  1
  Ta  Ta48  1  0.768398  0.119812  0.439545  1
  Ta  Ta49  1  0.514921  0.354679  0.364712  1
  Ta  Ta50  1  0.515929  0.892874  0.411249  1
  Ta  Ta51  1  0.945202  0.822609  0.419065  1
  Ta  Ta52  1  0.942017  0.282805  0.373975  1
  Ta  Ta53  1  0.594205  0.463436  0.404692  1
  Ta  Ta54  1  0.595880  0.002896  0.450575  1
  Ta  Ta55  1  0.946319  0.694567  0.382376  1
  Ta  Ta56  1  0.945964  0.235095  0.428163  1
  Ta  Ta57  1  0.088111  0.504776  0.450356  1
  Ta  Ta58  1  0.086351  0.964722  0.404956  1
  Ta  Ta59  1  0.437246  0.732533  0.427346  1
  Ta  Ta60  1  0.440787  0.193864  0.380500  1
  Ta  Ta61  1  0.088873  0.551755  0.396184  1
  Ta  Ta62  1  0.087792  0.092321  0.442111  1
  Ta  Ta63  1  0.516672  0.623029  0.388037  1
  Ta  Ta64  1  0.516542  0.163316  0.434524  1
  Ta  Ta65  1  0.706087  0.740104  0.427107  1
  Ta  Ta66  1  0.707766  0.197724  0.384134  1
  Ta  Ta67  1  0.768946  0.477370  0.453744  1
  Ta  Ta68  1  0.766941  0.937186  0.407322  1
  Ta  Ta69  1  0.711099  0.782453  0.373580  1
  Ta  Ta70  1  0.707054  0.319642  0.420539  1
  Ta  Ta71  1  0.904318  0.435688  0.408069  1
  Ta  Ta72  1  0.904184  0.975549  0.453521  1
  Ta  Ta73  1  0.129252  0.705298  0.430468  1
  Ta  Ta74  1  0.127509  0.167357  0.384906  1
  Ta  Ta75  1  0.327447  0.586683  0.441501  1
  Ta  Ta76  1  0.321757  0.051184  0.397032  1
  Ta  Ta77  1  0.266009  0.667581  0.384177  1
  Ta  Ta78  1  0.265223  0.207543  0.430447  1
  Ta  Ta79  1  0.325755  0.468492  0.403116  1
  Ta  Ta80  1  0.327257  0.009404  0.450092  1
  Ta  Ta81  1  0.904722  0.621583  0.438995  1
  Ta  Ta82  1  0.903511  0.080628  0.393550  1
  Ta  Ta83  1  0.596457  0.593825  0.441423  1
  Ta  Ta84  1  0.589842  0.051310  0.395269  1
  Ta  Ta85  1  0.442007  0.782107  0.371517  1
  Ta  Ta86  1  0.438597  0.323094  0.417810  1
  Ta  Ta87  1  0.125285  0.812649  0.370043  1
  Ta  Ta88  1  0.129618  0.350971  0.415713  1
  Ta  Ta89  1  0.266175  0.930506  0.507599  1
  Ta  Ta90  1  0.265861  0.389727  0.461441  1
  Ta  Ta91  1  0.768991  0.660312  0.484831  1
  Ta  Ta92  1  0.770374  0.200340  0.530917  1
  Ta  Ta93  1  0.517238  0.433437  0.457487  1
  Ta  Ta94  1  0.517853  0.973889  0.503461  1
  Ta  Ta95  1  0.946979  0.902343  0.510589  1
  Ta  Ta96  1  0.946830  0.362357  0.465095  1
  Ta  Ta97  1  0.596064  0.543886  0.496805  1
  Ta  Ta98  1  0.597496  0.084100  0.542916  1
  Ta  Ta99  1  0.946314  0.775161  0.473305  1
  Ta  Ta100  1  0.947861  0.314864  0.519350  1
  Ta  Ta101  1  0.089077  0.584018  0.541539  1
  Ta  Ta102  1  0.088358  0.045135  0.496333  1
  Ta  Ta103  1  0.439943  0.814051  0.519254  1
  Ta  Ta104  1  0.439202  0.273468  0.473360  1
  Ta  Ta105  1  0.088230  0.631951  0.487409  1
  Ta  Ta106  1  0.089367  0.171879  0.533693  1
  Ta  Ta107  1  0.517447  0.703413  0.480384  1
  Ta  Ta108  1  0.518708  0.243779  0.526640  1
  Ta  Ta109  1  0.709008  0.819110  0.518946  1
  Ta  Ta110  1  0.708277  0.279409  0.473788  1
  Ta  Ta111  1  0.769897  0.557068  0.545318  1
  Ta  Ta112  1  0.769447  0.017111  0.499388  1
  Ta  Ta113  1  0.707480  0.858043  0.465504  1
  Ta  Ta114  1  0.708969  0.398672  0.511585  1
  Ta  Ta115  1  0.905536  0.515840  0.499487  1
  Ta  Ta116  1  0.906050  0.055629  0.545242  1
  Ta  Ta117  1  0.129890  0.785791  0.521656  1
  Ta  Ta118  1  0.130141  0.245781  0.476590  1
  Ta  Ta119  1  0.327688  0.667553  0.532587  1
  Ta  Ta120  1  0.326807  0.128330  0.488137  1
  Ta  Ta121  1  0.265748  0.746625  0.475849  1
  Ta  Ta122  1  0.267017  0.286537  0.522224  1
  Ta  Ta123  1  0.326826  0.547864  0.495019  1
  Ta  Ta124  1  0.328052  0.089718  0.541637  1
  Ta  Ta125  1  0.905582  0.701176  0.530327  1
  Ta  Ta126  1  0.905448  0.161485  0.484932  1
  Ta  Ta127  1  0.596676  0.673702  0.533713  1
  Ta  Ta128  1  0.596042  0.133470  0.487569  1
  Ta  Ta129  1  0.438377  0.863310  0.464147  1
  Ta  Ta130  1  0.439602  0.403168  0.510303  1
  Ta  Ta131  1  0.129323  0.891575  0.461816  1
  Ta  Ta132  1  0.130505  0.430809  0.507296  1
  Ta  Ta133  1  0.269517  0.009582  0.599819  1
  Ta  Ta134  1  0.267084  0.468884  0.553088  1
  Ta  Ta135  1  0.769931  0.739206  0.576519  1
  Ta  Ta136  1  0.771459  0.277986  0.622737  1
  Ta  Ta137  1  0.518757  0.513478  0.549576  1
  Ta  Ta138  1  0.520170  0.054733  0.595951  1
  Ta  Ta139  1  0.949310  0.982522  0.602073  1
  Ta  Ta140  1  0.948077  0.441879  0.556427  1
  Ta  Ta141  1  0.594529  0.624973  0.589517  1
  Ta  Ta142  1  0.593095  0.165219  0.635888  1
  Ta  Ta143  1  0.947038  0.855087  0.564724  1
  Ta  Ta144  1  0.947893  0.394500  0.610616  1
  Ta  Ta145  1  0.094159  0.663997  0.631803  1
  Ta  Ta146  1  0.091403  0.124327  0.588072  1
  Ta  Ta147  1  0.449596  0.896975  0.611663  1
  Ta  Ta148  1  0.440631  0.353386  0.565868  1
  Ta  Ta149  1  0.089079  0.712328  0.577989  1
  Ta  Ta150  1  0.091519  0.252275  0.624738  1
  Ta  Ta151  1  0.519574  0.784390  0.572208  1
  Ta  Ta152  1  0.521196  0.324702  0.619175  1
  Ta  Ta153  1  0.715823  0.894667  0.610337  1
  Ta  Ta154  1  0.709730  0.359734  0.565088  1
  Ta  Ta155  1  0.768373  0.635869  0.637331  1
  Ta  Ta156  1  0.772319  0.098109  0.590932  1
  Ta  Ta157  1  0.707571  0.937812  0.557236  1
  Ta  Ta158  1  0.709849  0.478773  0.603136  1
  Ta  Ta159  1  0.906364  0.595970  0.590874  1
  Ta  Ta160  1  0.912284  0.133896  0.637198  1
  Ta  Ta161  1  0.131279  0.866610  0.613047  1
  Ta  Ta162  1  0.132014  0.325178  0.568119  1
  Ta  Ta163  1  0.327569  0.751880  0.618527  1
  Ta  Ta164  1  0.330982  0.206951  0.580283  1
  Ta  Ta165  1  0.266945  0.828325  0.566730  1
  Ta  Ta166  1  0.269507  0.367463  0.613455  1
  Ta  Ta167  1  0.326458  0.624840  0.585486  1
  Ta  Ta168  1  0.324989  0.164256  0.633973  1
  Ta  Ta169  1  0.907353  0.779004  0.621979  1
  Ta  Ta170  1  0.907412  0.241371  0.576357  1
  Ta  Ta171  1  0.592742  0.752622  0.627372  1
  Ta  Ta172  1  0.599496  0.214748  0.579722  1
  Ta  Ta173  1  0.439732  0.945166  0.556245  1
  Ta  Ta174  1  0.442068  0.484145  0.602700  1
  Ta  Ta175  1  0.131281  0.972172  0.553460  1
  Ta  Ta176  1  0.131954  0.510458  0.598841  1
  Ta  Ta177  1  0.263696  0.092675  0.691551  1
  Ta  Ta178  1  0.269068  0.547173  0.645245  1
  Ta  Ta179  1  0.772189  0.817169  0.668244  1
  Ta  Ta180  1  0.785231  0.368208  0.710355  1
  Ta  Ta181  1  0.521167  0.592804  0.643098  1
  Ta  Ta182  1  0.512548  0.137868  0.688406  1
  Ta  Ta183  1  0.957752  0.058087  0.692415  1
  Ta  Ta184  1  0.951747  0.524753  0.646916  1
  Ta  Ta185  1  0.599395  0.705693  0.685235  1
  Ta  Ta186  1  0.628731  0.243009  0.725748  1
  Ta  Ta187  1  0.947792  0.933888  0.656347  1
  Ta  Ta188  1  0.965413  0.483462  0.698205  1
  Ta  Ta189  1  0.093386  0.749146  0.718729  1
  Ta  Ta190  1  0.094330  0.205015  0.678069  1
  Ta  Ta191  1  0.427042  0.966377  0.705109  1
  Ta  Ta192  1  0.450142  0.438197  0.659690  1
  Ta  Ta193  1  0.091789  0.792405  0.668263  1
  Ta  Ta194  1  0.090699  0.336379  0.710147  1
  Ta  Ta195  1  0.524929  0.864884  0.665381  1
  Ta  Ta196  1  0.528195  0.409937  0.709905  1
  Ta  Ta197  1  0.697296  -0.010851  0.695548  1
  Ta  Ta198  1  0.719558  0.435571  0.656225  1
  Ta  Ta199  1  0.798327  0.717840  0.723224  1
  Ta  Ta200  1  0.769698  0.173817  0.680746  1
  Ta  Ta201  1  0.714269  0.020118  0.645003  1
  Ta  Ta202  1  0.707801  0.552854  0.692450  1
  Ta  Ta203  1  0.914284  0.674350  0.679841  1
  Ta  Ta204  1  0.912103  0.221269  0.720857  1
  Ta  Ta205  1  0.145969  0.933895  0.702706  1
  Ta  Ta206  1  0.132150  0.407607  0.658752  1
  Ta  Ta207  1  0.347348  0.800380  0.708431  1
  Ta  Ta208  1  0.327620  0.291947  0.667251  1
  Ta  Ta209  1  0.275155  0.903292  0.658287  1
  Ta  Ta210  1  0.270792  0.448567  0.701985  1
  Ta  Ta211  1  0.332214  0.707501  0.667879  1
  Ta  Ta212  1  0.354809  0.264299  0.716790  1
  Ta  Ta213  1  0.905124  0.869626  0.709673  1
  Ta  Ta214  1  0.911344  0.319556  0.667218  1
  Ta  Ta215  1  0.620556  0.843568  0.717508  1
  Ta  Ta216  1  0.598411  0.295026  0.674194  1
  Ta  Ta217  1  0.446180  0.023421  0.651815  1
  Ta  Ta218  1  0.426857  0.581826  0.697231  1
  Ta  Ta219  1  0.135497  0.046864  0.646338  1
  Ta  Ta220  1  0.147853  0.606031  0.689323  1
