# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   18.20204357
_cell_length_b   14.18098876
_cell_length_c   48.60699524
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   110.52075181
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta308
_cell_volume   11750.4424551
_cell_formula_units_Z   308
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  0.859902  0.951365  0.304138  1
  Ta  Ta2  1  0.359902  0.951365  0.304138  1
  Ta  Ta3  1  0.625804  0.459878  0.312858  1
  Ta  Ta4  1  0.125804  0.459878  0.312858  1
  Ta  Ta5  1  0.787840  0.740402  0.281892  1
  Ta  Ta6  1  0.287840  0.740402  0.281892  1
  Ta  Ta7  1  0.812236  0.312814  0.281078  1
  Ta  Ta8  1  0.312236  0.312814  0.281078  1
  Ta  Ta9  1  0.766711  0.625120  0.324738  1
  Ta  Ta10  1  0.266711  0.625120  0.324738  1
  Ta  Ta11  1  0.485406  0.316218  0.300943  1
  Ta  Ta12  1  0.985406  0.316218  0.300943  1
  Ta  Ta13  1  0.669843  0.156176  0.278384  1
  Ta  Ta14  1  0.169843  0.156176  0.278384  1
  Ta  Ta15  1  0.529134  0.694566  0.333446  1
  Ta  Ta16  1  0.029134  0.694566  0.333446  1
  Ta  Ta17  1  0.646848  0.335397  0.271405  1
  Ta  Ta18  1  0.146848  0.335397  0.271405  1
  Ta  Ta19  1  0.561917  0.827448  0.288340  1
  Ta  Ta20  1  0.061917  0.827448  0.288340  1
  Ta  Ta21  1  0.441423  0.482747  0.298975  1
  Ta  Ta22  1  0.941423  0.482747  0.298975  1
  Ta  Ta23  1  0.760285  0.382824  0.322951  1
  Ta  Ta24  1  0.260285  0.382824  0.322951  1
  Ta  Ta25  1  0.425382  0.659819  0.285820  1
  Ta  Ta26  1  0.925382  0.659819  0.285820  1
  Ta  Ta27  1  0.782974  0.514378  0.281016  1
  Ta  Ta28  1  0.282974  0.514378  0.281016  1
  Ta  Ta29  1  0.495648  0.146285  0.277173  1
  Ta  Ta30  1  0.995648  0.146285  0.277173  1
  Ta  Ta31  1  0.694007  0.807205  0.318994  1
  Ta  Ta32  1  0.194007  0.807205  0.318994  1
  Ta  Ta33  1  0.538944  0.023156  0.309414  1
  Ta  Ta34  1  0.038944  0.023156  0.309414  1
  Ta  Ta35  1  0.698578  0.984939  0.294571  1
  Ta  Ta36  1  0.198578  0.984939  0.294571  1
  Ta  Ta37  1  0.610114  0.246093  0.321981  1
  Ta  Ta38  1  0.110114  0.246093  0.321981  1
  Ta  Ta39  1  0.604314  0.628443  0.294163  1
  Ta  Ta40  1  0.104314  0.628443  0.294163  1
  Ta  Ta41  1  0.921663  0.803434  0.320909  1
  Ta  Ta42  1  0.421663  0.803434  0.320909  1
  Ta  Ta43  1  0.837936  0.143221  0.296020  1
  Ta  Ta44  1  0.337936  0.143221  0.296020  1
  Ta  Ta45  1  0.948871  0.756403  0.375109  1
  Ta  Ta46  1  0.448871  0.756403  0.375109  1
  Ta  Ta47  1  0.713989  0.266727  0.377301  1
  Ta  Ta48  1  0.213989  0.266727  0.377301  1
  Ta  Ta49  1  0.879753  0.561086  0.341735  1
  Ta  Ta50  1  0.379753  0.561086  0.341735  1
  Ta  Ta51  1  0.940987  0.135075  0.337009  1
  Ta  Ta52  1  0.440987  0.135075  0.337009  1
  Ta  Ta53  1  0.852335  0.431437  0.386346  1
  Ta  Ta54  1  0.352335  0.431437  0.386346  1
  Ta  Ta55  1  0.575702  0.114025  0.368669  1
  Ta  Ta56  1  0.075702  0.114025  0.368669  1
  Ta  Ta57  1  0.777502  0.995264  0.346866  1
  Ta  Ta58  1  0.277502  0.995264  0.346866  1
  Ta  Ta59  1  0.617491  0.503715  0.402876  1
  Ta  Ta60  1  0.117491  0.503715  0.402876  1
  Ta  Ta61  1  0.719192  0.148269  0.332455  1
  Ta  Ta62  1  0.219192  0.148269  0.332455  1
  Ta  Ta63  1  0.650001  0.636487  0.356180  1
  Ta  Ta64  1  0.150001  0.636487  0.356180  1
  Ta  Ta65  1  0.534565  0.302254  0.364469  1
  Ta  Ta66  1  0.034565  0.302254  0.364469  1
  Ta  Ta67  1  0.851578  0.182947  0.383891  1
  Ta  Ta68  1  0.351578  0.182947  0.383891  1
  Ta  Ta69  1  0.513426  0.477921  0.349367  1
  Ta  Ta70  1  0.013426  0.477921  0.349367  1
  Ta  Ta71  1  0.875711  0.313325  0.340533  1
  Ta  Ta72  1  0.375711  0.313325  0.340533  1
  Ta  Ta73  1  0.589979  0.926173  0.343698  1
  Ta  Ta74  1  0.089979  0.926173  0.343698  1
  Ta  Ta75  1  0.786020  0.617992  0.387396  1
  Ta  Ta76  1  0.286020  0.617992  0.387396  1
  Ta  Ta77  1  0.635661  0.828927  0.378753  1
  Ta  Ta78  1  0.135661  0.828927  0.378753  1
  Ta  Ta79  1  0.795464  0.800045  0.359219  1
  Ta  Ta80  1  0.295464  0.800045  0.359219  1
  Ta  Ta81  1  0.699370  0.053763  0.390149  1
  Ta  Ta82  1  0.199370  0.053763  0.390149  1
  Ta  Ta83  1  0.690919  0.443547  0.363300  1
  Ta  Ta84  1  0.190919  0.443547  0.363300  1
  Ta  Ta85  1  0.008586  0.607159  0.390296  1
  Ta  Ta86  1  0.508586  0.607159  0.390296  1
  Ta  Ta87  1  0.932456  0.955111  0.362065  1
  Ta  Ta88  1  0.432456  0.955111  0.362065  1
  Ta  Ta89  1  0.041682  0.563812  0.444690  1
  Ta  Ta90  1  0.541682  0.563812  0.444690  1
  Ta  Ta91  1  0.806865  0.078217  0.444005  1
  Ta  Ta92  1  0.306865  0.078217  0.444005  1
  Ta  Ta93  1  0.966898  0.367918  0.408475  1
  Ta  Ta94  1  0.466898  0.367918  0.408475  1
  Ta  Ta95  1  0.032216  0.941196  0.406004  1
  Ta  Ta96  1  0.532216  0.941196  0.406004  1
  Ta  Ta97  1  0.945514  0.239377  0.453811  1
  Ta  Ta98  1  0.445514  0.239377  0.453811  1
  Ta  Ta99  1  0.667782  0.922664  0.437743  1
  Ta  Ta100  1  0.167782  0.922664  0.437743  1
  Ta  Ta101  1  0.868649  0.803626  0.416217  1
  Ta  Ta102  1  0.368649  0.803626  0.416217  1
  Ta  Ta103  1  0.710768  0.308994  0.469810  1
  Ta  Ta104  1  0.210768  0.308994  0.469810  1
  Ta  Ta105  1  0.808899  0.951036  0.402272  1
  Ta  Ta106  1  0.308899  0.951036  0.402272  1
  Ta  Ta107  1  0.742248  0.442258  0.423873  1
  Ta  Ta108  1  0.242248  0.442258  0.423873  1
  Ta  Ta109  1  0.625844  0.111009  0.432496  1
  Ta  Ta110  1  0.125844  0.111009  0.432496  1
  Ta  Ta111  1  0.943357  0.994056  0.451967  1
  Ta  Ta112  1  0.443357  0.994056  0.451967  1
  Ta  Ta113  1  0.603515  0.285040  0.416727  1
  Ta  Ta114  1  0.103515  0.285040  0.416727  1
  Ta  Ta115  1  0.965781  0.122682  0.406676  1
  Ta  Ta116  1  0.465781  0.122682  0.406676  1
  Ta  Ta117  1  0.682190  0.732929  0.413479  1
  Ta  Ta118  1  0.182190  0.732929  0.413479  1
  Ta  Ta119  1  0.878065  0.423864  0.453926  1
  Ta  Ta120  1  0.378065  0.423864  0.453926  1
  Ta  Ta121  1  0.727712  0.635695  0.447911  1
  Ta  Ta122  1  0.227712  0.635695  0.447911  1
  Ta  Ta123  1  0.885608  0.605972  0.429356  1
  Ta  Ta124  1  0.385608  0.605972  0.429356  1
  Ta  Ta125  1  0.791387  0.862882  0.459240  1
  Ta  Ta126  1  0.291387  0.862882  0.459240  1
  Ta  Ta127  1  0.785519  0.251586  0.428076  1
  Ta  Ta128  1  0.285519  0.251586  0.428076  1
  Ta  Ta129  1  0.100479  0.412799  0.458241  1
  Ta  Ta130  1  0.600479  0.412799  0.458241  1
  Ta  Ta131  1  0.024336  0.761579  0.431775  1
  Ta  Ta132  1  0.524336  0.761579  0.431775  1
  Ta  Ta133  1  0.134184  0.369481  0.512445  1
  Ta  Ta134  1  0.634184  0.369481  0.512445  1
  Ta  Ta135  1  0.898330  0.887016  0.512557  1
  Ta  Ta136  1  0.398330  0.887016  0.512557  1
  Ta  Ta137  1  0.059357  0.176204  0.476730  1
  Ta  Ta138  1  0.559357  0.176204  0.476730  1
  Ta  Ta139  1  0.124050  0.748625  0.475275  1
  Ta  Ta140  1  0.624050  0.748625  0.475275  1
  Ta  Ta141  1  0.037289  0.047752  0.522129  1
  Ta  Ta142  1  0.537289  0.047752  0.522129  1
  Ta  Ta143  1  0.759724  0.729887  0.506348  1
  Ta  Ta144  1  0.259724  0.729887  0.506348  1
  Ta  Ta145  1  0.959864  0.609693  0.484851  1
  Ta  Ta146  1  0.459864  0.609693  0.484851  1
  Ta  Ta147  1  0.802698  0.116531  0.537960  1
  Ta  Ta148  1  0.302698  0.116531  0.537960  1
  Ta  Ta149  1  0.900796  0.759318  0.471204  1
  Ta  Ta150  1  0.400796  0.759318  0.471204  1
  Ta  Ta151  1  0.834480  0.249243  0.490926  1
  Ta  Ta152  1  0.334480  0.249243  0.490926  1
  Ta  Ta153  1  0.717207  0.918965  0.501293  1
  Ta  Ta154  1  0.217207  0.918965  0.501293  1
  Ta  Ta155  1  0.035030  0.802748  0.520554  1
  Ta  Ta156  1  0.535030  0.802748  0.520554  1
  Ta  Ta157  1  0.696032  0.092251  0.484543  1
  Ta  Ta158  1  0.196032  0.092251  0.484543  1
  Ta  Ta159  1  0.056877  0.931709  0.475115  1
  Ta  Ta160  1  0.556877  0.931709  0.475115  1
  Ta  Ta161  1  0.773945  0.538057  0.481716  1
  Ta  Ta162  1  0.273945  0.538057  0.481716  1
  Ta  Ta163  1  0.969993  0.230728  0.521966  1
  Ta  Ta164  1  0.469993  0.230728  0.521966  1
  Ta  Ta165  1  0.820093  0.441027  0.515575  1
  Ta  Ta166  1  0.320093  0.441027  0.515575  1
  Ta  Ta167  1  0.977424  0.411982  0.497074  1
  Ta  Ta168  1  0.477424  0.411982  0.497074  1
  Ta  Ta169  1  0.883348  0.669945  0.527441  1
  Ta  Ta170  1  0.383348  0.669945  0.527441  1
  Ta  Ta171  1  0.876921  0.060160  0.495921  1
  Ta  Ta172  1  0.376921  0.060160  0.495921  1
  Ta  Ta173  1  0.193220  0.219898  0.526033  1
  Ta  Ta174  1  0.693220  0.219898  0.526033  1
  Ta  Ta175  1  0.116655  0.567252  0.500265  1
  Ta  Ta176  1  0.616655  0.567252  0.500265  1
  Ta  Ta177  1  0.225348  0.176493  0.580912  1
  Ta  Ta178  1  0.725348  0.176493  0.580912  1
  Ta  Ta179  1  0.990222  0.693789  0.580402  1
  Ta  Ta180  1  0.490222  0.693789  0.580402  1
  Ta  Ta181  1  0.150892  0.985325  0.545164  1
  Ta  Ta182  1  0.650892  0.985325  0.545164  1
  Ta  Ta183  1  0.216255  0.555017  0.543369  1
  Ta  Ta184  1  0.716255  0.555017  0.543369  1
  Ta  Ta185  1  0.128180  0.856227  0.590133  1
  Ta  Ta186  1  0.628180  0.856227  0.590133  1
  Ta  Ta187  1  0.851789  0.536393  0.573684  1
  Ta  Ta188  1  0.351789  0.536393  0.573684  1
  Ta  Ta189  1  0.052396  0.415331  0.552681  1
  Ta  Ta190  1  0.552396  0.415331  0.552681  1
  Ta  Ta191  1  0.894440  0.924604  0.606894  1
  Ta  Ta192  1  0.394440  0.924604  0.606894  1
  Ta  Ta193  1  0.993457  0.566003  0.539082  1
  Ta  Ta194  1  0.493457  0.566003  0.539082  1
  Ta  Ta195  1  0.926159  0.056906  0.559395  1
  Ta  Ta196  1  0.426159  0.056906  0.559395  1
  Ta  Ta197  1  0.808958  0.726435  0.569307  1
  Ta  Ta198  1  0.308958  0.726435  0.569307  1
  Ta  Ta199  1  0.127374  0.609728  0.588834  1
  Ta  Ta200  1  0.627374  0.609728  0.588834  1
  Ta  Ta201  1  0.787588  0.900466  0.553048  1
  Ta  Ta202  1  0.287588  0.900466  0.553048  1
  Ta  Ta203  1  0.148879  0.739170  0.543584  1
  Ta  Ta204  1  0.648879  0.739170  0.543584  1
  Ta  Ta205  1  0.866166  0.343740  0.549467  1
  Ta  Ta206  1  0.366166  0.343740  0.549467  1
  Ta  Ta207  1  0.061123  0.038500  0.590817  1
  Ta  Ta208  1  0.561123  0.038500  0.590817  1
  Ta  Ta209  1  0.911750  0.247007  0.583858  1
  Ta  Ta210  1  0.411750  0.247007  0.583858  1
  Ta  Ta211  1  0.069468  0.218442  0.565494  1
  Ta  Ta212  1  0.569468  0.218442  0.565494  1
  Ta  Ta213  1  0.976632  0.475134  0.594514  1
  Ta  Ta214  1  0.476632  0.475134  0.594514  1
  Ta  Ta215  1  0.968027  0.868115  0.564503  1
  Ta  Ta216  1  0.468027  0.868115  0.564503  1
  Ta  Ta217  1  0.285137  0.027839  0.594650  1
  Ta  Ta218  1  0.785137  0.027839  0.594650  1
  Ta  Ta219  1  0.208401  0.373429  0.568046  1
  Ta  Ta220  1  0.708401  0.373429  0.568046  1
  Ta  Ta221  1  0.316512  0.982891  0.649665  1
  Ta  Ta222  1  0.816512  0.982891  0.649665  1
  Ta  Ta223  1  0.081972  0.501376  0.648503  1
  Ta  Ta224  1  0.581972  0.501376  0.648503  1
  Ta  Ta225  1  0.242421  0.794447  0.612753  1
  Ta  Ta226  1  0.742421  0.794447  0.612753  1
  Ta  Ta227  1  0.307600  0.362061  0.610637  1
  Ta  Ta228  1  0.807600  0.362061  0.610637  1
  Ta  Ta229  1  0.222427  0.667212  0.657010  1
  Ta  Ta230  1  0.722427  0.667212  0.657010  1
  Ta  Ta231  1  0.944246  0.343815  0.641627  1
  Ta  Ta232  1  0.444246  0.343815  0.641627  1
  Ta  Ta233  1  0.144114  0.223388  0.622047  1
  Ta  Ta234  1  0.644114  0.223388  0.622047  1
  Ta  Ta235  1  0.979400  0.735137  0.676643  1
  Ta  Ta236  1  0.479400  0.735137  0.676643  1
  Ta  Ta237  1  0.085285  0.372207  0.607461  1
  Ta  Ta238  1  0.585285  0.372207  0.607461  1
  Ta  Ta239  1  0.017756  0.864670  0.627931  1
  Ta  Ta240  1  0.517756  0.864670  0.627931  1
  Ta  Ta241  1  0.905011  0.534516  0.634529  1
  Ta  Ta242  1  0.405011  0.534516  0.634529  1
  Ta  Ta243  1  0.212632  0.415285  0.657197  1
  Ta  Ta244  1  0.712632  0.415285  0.657197  1
  Ta  Ta245  1  0.880027  0.711044  0.620400  1
  Ta  Ta246  1  0.380027  0.711044  0.620400  1
  Ta  Ta247  1  0.241922  0.545678  0.611581  1
  Ta  Ta248  1  0.741922  0.545678  0.611581  1
  Ta  Ta249  1  0.957990  0.151076  0.618459  1
  Ta  Ta250  1  0.457990  0.151076  0.618459  1
  Ta  Ta251  1  0.155068  0.846755  0.658633  1
  Ta  Ta252  1  0.655068  0.846755  0.658633  1
  Ta  Ta253  1  0.002409  0.053098  0.653344  1
  Ta  Ta254  1  0.502409  0.053098  0.653344  1
  Ta  Ta255  1  0.161787  0.025791  0.633927  1
  Ta  Ta256  1  0.661787  0.025791  0.633927  1
  Ta  Ta257  1  0.063815  0.284657  0.664729  1
  Ta  Ta258  1  0.563815  0.284657  0.664729  1
  Ta  Ta259  1  0.058274  0.677468  0.632187  1
  Ta  Ta260  1  0.558274  0.677468  0.632187  1
  Ta  Ta261  1  0.376734  0.832113  0.665610  1
  Ta  Ta262  1  0.876734  0.832113  0.665610  1
  Ta  Ta263  1  0.298670  0.180051  0.637278  1
  Ta  Ta264  1  0.798670  0.180051  0.637278  1
  Ta  Ta265  1  0.449739  0.861130  0.723263  1
  Ta  Ta266  1  0.949739  0.861130  0.723263  1
  Ta  Ta267  1  0.165405  0.311964  0.713686  1
  Ta  Ta268  1  0.665405  0.311964  0.713686  1
  Ta  Ta269  1  0.331897  0.587129  0.673840  1
  Ta  Ta270  1  0.831897  0.587129  0.673840  1
  Ta  Ta271  1  0.398135  0.172998  0.678329  1
  Ta  Ta272  1  0.898135  0.172998  0.678329  1
  Ta  Ta273  1  0.313167  0.467360  0.717928  1
  Ta  Ta274  1  0.813167  0.467360  0.717928  1
  Ta  Ta275  1  0.025541  0.144234  0.709231  1
  Ta  Ta276  1  0.525541  0.144234  0.709231  1
  Ta  Ta277  1  0.236045  0.029340  0.691919  1
  Ta  Ta278  1  0.736045  0.029340  0.691919  1
  Ta  Ta279  1  0.145526  0.669913  0.740879  1
  Ta  Ta280  1  0.645526  0.669913  0.740879  1
  Ta  Ta281  1  0.171166  0.175899  0.676449  1
  Ta  Ta282  1  0.671166  0.175899  0.676449  1
  Ta  Ta283  1  0.107039  0.671686  0.690393  1
  Ta  Ta284  1  0.607039  0.671686  0.690393  1
  Ta  Ta285  1  0.988238  0.348069  0.704308  1
  Ta  Ta286  1  0.488238  0.348069  0.704308  1
  Ta  Ta287  1  0.298742  0.232255  0.718030  1
  Ta  Ta288  1  0.798742  0.232255  0.718030  1
  Ta  Ta289  1  0.970089  0.520357  0.686106  1
  Ta  Ta290  1  0.470089  0.520357  0.686106  1
  Ta  Ta291  1  0.327872  0.352273  0.674435  1
  Ta  Ta292  1  0.827872  0.352273  0.674435  1
  Ta  Ta293  1  0.058326  0.956348  0.685332  1
  Ta  Ta294  1  0.558326  0.956348  0.685332  1
  Ta  Ta295  1  0.304635  0.683761  0.715606  1
  Ta  Ta296  1  0.804635  0.683761  0.715606  1
  Ta  Ta297  1  0.107780  0.844711  0.720645  1
  Ta  Ta298  1  0.607780  0.844711  0.720645  1
  Ta  Ta299  1  0.254779  0.833433  0.702473  1
  Ta  Ta300  1  0.754779  0.833433  0.702473  1
  Ta  Ta301  1  0.134657  0.072692  0.730051  1
  Ta  Ta302  1  0.634657  0.072692  0.730051  1
  Ta  Ta303  1  0.156297  0.505963  0.701158  1
  Ta  Ta304  1  0.656297  0.505963  0.701158  1
  Ta  Ta305  1  0.463398  0.655017  0.727511  1
  Ta  Ta306  1  0.963398  0.655017  0.727511  1
  Ta  Ta307  1  0.391115  0.992999  0.701801  1
  Ta  Ta308  1  0.891115  0.992999  0.701801  1
