# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.44057013
_cell_length_b   9.19231990
_cell_length_c   48.93476638
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.94267950
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta
_chemical_formula_sum   Ta110
_cell_volume   4696.41695048
_cell_formula_units_Z   110
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  0.273891  0.375451  0.367933  1
  Ta  Ta2  1  0.762588  0.875305  0.367895  1
  Ta  Ta3  1  0.586927  0.420587  0.364083  1
  Ta  Ta4  1  0.032799  0.030107  0.295581  1
  Ta  Ta5  1  0.598035  0.429575  0.309961  1
  Ta  Ta6  1  0.940948  0.052883  0.345831  1
  Ta  Ta7  1  0.095575  0.553043  0.345845  1
  Ta  Ta8  1  0.438191  0.929799  0.309976  1
  Ta  Ta9  1  1.003508  0.529958  0.295597  1
  Ta  Ta10  1  0.449543  0.920658  0.364101  1
  Ta  Ta11  1  0.745626  -0.008224  0.302769  1
  Ta  Ta12  1  0.826584  0.548138  0.349901  1
  Ta  Ta13  1  0.629086  0.112734  0.343688  1
  Ta  Ta14  1  0.846033  0.292435  0.322014  1
  Ta  Ta15  1  0.190175  0.792629  0.322036  1
  Ta  Ta16  1  0.407331  0.612869  0.343662  1
  Ta  Ta17  1  0.209844  0.048236  0.349961  1
  Ta  Ta18  1  0.290582  0.491590  0.302800  1
  Ta  Ta19  1  0.916720  0.780629  0.319526  1
  Ta  Ta20  1  0.631907  0.736865  0.328045  1
  Ta  Ta21  1  0.404481  0.236872  0.328076  1
  Ta  Ta22  1  0.119582  0.280584  0.319556  1
  Ta  Ta23  1  0.270571  0.632061  0.452690  1
  Ta  Ta24  1  0.766313  0.131842  0.452640  1
  Ta  Ta25  1  0.588641  0.679291  0.447235  1
  Ta  Ta26  1  0.022571  0.299345  0.375008  1
  Ta  Ta27  1  0.590730  0.690091  0.389824  1
  Ta  Ta28  1  0.939014  0.318894  0.430375  1
  Ta  Ta29  1  0.098084  0.819204  0.430406  1
  Ta  Ta30  1  0.445849  0.190152  0.389858  1
  Ta  Ta31  1  1.013884  0.799203  0.375020  1
  Ta  Ta32  1  0.448208  0.179360  0.447263  1
  Ta  Ta33  1  0.768827  0.239004  0.383353  1
  Ta  Ta34  1  0.826698  0.812353  0.432154  1
  Ta  Ta35  1  0.631212  0.365762  0.425810  1
  Ta  Ta36  1  0.829818  0.557513  0.404799  1
  Ta  Ta37  1  0.206601  0.058036  0.404863  1
  Ta  Ta38  1  0.405508  0.865923  0.425808  1
  Ta  Ta39  1  0.210367  0.312811  0.432226  1
  Ta  Ta40  1  0.267722  0.739170  0.383372  1
  Ta  Ta41  1  0.936173  0.044064  0.404616  1
  Ta  Ta42  1  0.631043  0.004512  0.410676  1
  Ta  Ta43  1  0.405636  0.504708  0.410678  1
  Ta  Ta44  1  0.100328  0.544344  0.404655  1
  Ta  Ta45  1  0.271648  0.893799  0.535993  1
  Ta  Ta46  1  0.765615  0.393572  0.535942  1
  Ta  Ta47  1  0.590085  0.937702  0.530837  1
  Ta  Ta48  1  1.018317  0.563473  0.459930  1
  Ta  Ta49  1  0.589088  0.948643  0.473236  1
  Ta  Ta50  1  0.936961  0.582234  0.514758  1
  Ta  Ta51  1  0.100502  0.082552  0.514792  1
  Ta  Ta52  1  0.447880  0.448727  0.473263  1
  Ta  Ta53  1  1.018584  0.063430  0.459937  1
  Ta  Ta54  1  0.447165  0.437794  0.530867  1
  Ta  Ta55  1  0.765779  0.495854  0.467623  1
  Ta  Ta56  1  0.829998  0.070580  0.516427  1
  Ta  Ta57  1  0.630955  0.626128  0.509522  1
  Ta  Ta58  1  0.829174  0.817424  0.488016  1
  Ta  Ta59  1  0.207574  0.317944  0.488087  1
  Ta  Ta60  1  0.406167  0.126321  0.509533  1
  Ta  Ta61  1  0.207527  0.571092  0.516502  1
  Ta  Ta62  1  0.271171  -0.003932  0.467668  1
  Ta  Ta63  1  0.936296  0.306315  0.489444  1
  Ta  Ta64  1  0.631083  0.261390  0.494448  1
  Ta  Ta65  1  0.405995  0.761582  0.494457  1
  Ta  Ta66  1  0.100477  0.806627  0.489487  1
  Ta  Ta67  1  0.265254  0.147702  0.620245  1
  Ta  Ta68  1  0.772445  0.647446  0.620233  1
  Ta  Ta69  1  0.593346  0.192876  0.613746  1
  Ta  Ta70  1  1.019098  0.825004  0.544496  1
  Ta  Ta71  1  0.589727  0.207910  0.556468  1
  Ta  Ta72  1  0.943632  0.843179  0.601713  1
  Ta  Ta73  1  0.094057  0.343552  0.601771  1
  Ta  Ta74  1  0.447646  0.707959  0.556500  1
  Ta  Ta75  1  1.018260  0.325124  0.544474  1
  Ta  Ta76  1  0.444282  0.692921  0.613784  1
  Ta  Ta77  1  0.767819  0.754318  0.551808  1
  Ta  Ta78  1  0.827516  0.328272  0.596411  1
  Ta  Ta79  1  0.632126  0.878995  0.593659  1
  Ta  Ta80  1  0.825600  0.068143  0.572399  1
  Ta  Ta81  1  0.211420  0.568829  0.572494  1
  Ta  Ta82  1  0.405383  0.379285  0.593659  1
  Ta  Ta83  1  0.210314  0.829159  0.596495  1
  Ta  Ta84  1  0.269489  0.254610  0.551865  1
  Ta  Ta85  1  0.942604  0.571123  0.574158  1
  Ta  Ta86  1  0.630554  0.521553  0.577985  1
  Ta  Ta87  1  0.406989  0.021790  0.577970  1
  Ta  Ta88  1  0.094349  0.071568  0.574171  1
  Ta  Ta89  1  0.300365  0.394438  0.700299  1
  Ta  Ta90  1  0.737730  0.894652  0.700276  1
  Ta  Ta91  1  0.597645  0.455073  0.693008  1
  Ta  Ta92  1  1.013119  0.089774  0.630221  1
  Ta  Ta93  1  0.586775  0.465067  0.639253  1
  Ta  Ta94  1  0.914349  0.122436  0.686114  1
  Ta  Ta95  1  0.123461  0.622336  0.686158  1
  Ta  Ta96  1  0.450964  0.965122  0.639259  1
  Ta  Ta97  1  0.024728  0.590064  0.630237  1
  Ta  Ta98  1  0.440372  0.955405  0.693025  1
  Ta  Ta99  1  0.765349  0.004586  0.637048  1
  Ta  Ta100  1  0.839956  0.580071  0.678425  1
  Ta  Ta101  1  0.632865  0.152075  0.675477  1
  Ta  Ta102  1  0.824636  0.331828  0.649649  1
  Ta  Ta103  1  0.213230  0.831838  0.649735  1
  Ta  Ta104  1  0.405015  0.652111  0.675523  1
  Ta  Ta105  1  0.197978  0.080280  0.678428  1
  Ta  Ta106  1  0.272441  0.504710  0.637107  1
  Ta  Ta107  1  0.947487  0.839854  0.663342  1
  Ta  Ta108  1  0.629847  0.769636  0.659474  1
  Ta  Ta109  1  0.407985  0.269688  0.659446  1
  Ta  Ta110  1  0.090244  0.339965  0.663364  1
