# generated using pymatgen
data_Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.31012286
_cell_length_b   14.27117197
_cell_length_c   50.22255062
_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   Ta90
_cell_volume   3805.94908262
_cell_formula_units_Z   90
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  0.513280  0.957884  0.298044  1
  Ta  Ta2  1  0.999745  0.447532  0.296552  1
  Ta  Ta3  1  0.500362  0.792441  0.324992  1
  Ta  Ta4  1  1.000045  0.547702  0.346123  1
  Ta  Ta5  1  0.000798  0.853451  0.395651  1
  Ta  Ta6  1  0.500178  0.617913  0.414230  1
  Ta  Ta7  1  0.999539  0.356518  0.346462  1
  Ta  Ta8  1  0.000855  0.050786  0.396610  1
  Ta  Ta9  1  0.498347  0.111379  0.326737  1
  Ta  Ta10  1  0.500068  0.289153  0.415041  1
  Ta  Ta11  1  0.500131  0.620064  0.357418  1
  Ta  Ta12  1  1.000239  0.655538  0.393975  1
  Ta  Ta13  1  0.000306  0.754228  0.345132  1
  Ta  Ta14  1  0.500498  0.788237  0.383130  1
  Ta  Ta15  1  1.000046  0.251754  0.395684  1
  Ta  Ta16  1  0.998955  0.153851  0.348546  1
  Ta  Ta17  1  0.499369  0.285630  0.358405  1
  Ta  Ta18  1  0.500344  0.118040  0.384838  1
  Ta  Ta19  1  1.000166  0.351347  0.443126  1
  Ta  Ta20  1  0.499765  0.450450  0.328654  1
  Ta  Ta21  1  0.500177  0.952018  0.413776  1
  Ta  Ta22  1  0.997788  0.052714  0.304679  1
  Ta  Ta23  1  0.252364  0.626941  0.302870  1
  Ta  Ta24  1  0.249401  0.452976  0.390326  1
  Ta  Ta25  1  0.252132  0.953241  0.352509  1
  Ta  Ta26  1  0.248375  0.266404  0.303663  1
  Ta  Ta27  1  0.750615  0.453003  0.390329  1
  Ta  Ta28  1  0.749476  0.266568  0.303691  1
  Ta  Ta29  1  0.747786  0.626965  0.302869  1
  Ta  Ta30  1  0.748777  0.953600  0.352808  1
  Ta  Ta31  1  0.500159  0.453863  0.442806  1
  Ta  Ta32  1  1.000151  0.952158  0.442953  1
  Ta  Ta33  1  0.500279  0.289850  0.471272  1
  Ta  Ta34  1  1.000117  0.050784  0.489826  1
  Ta  Ta35  1  1.000258  0.353881  0.539100  1
  Ta  Ta36  1  0.500099  0.115384  0.558350  1
  Ta  Ta37  1  1.000164  0.854165  0.489712  1
  Ta  Ta38  1  0.000341  0.552083  0.539122  1
  Ta  Ta39  1  0.500288  0.617383  0.470889  1
  Ta  Ta40  1  0.500130  0.790410  0.558243  1
  Ta  Ta41  1  0.500154  0.118533  0.501139  1
  Ta  Ta42  1  1.000137  0.153611  0.538715  1
  Ta  Ta43  1  1.000243  0.250404  0.490656  1
  Ta  Ta44  1  0.500222  0.285862  0.528260  1
  Ta  Ta45  1  1.000183  0.752129  0.538627  1
  Ta  Ta46  1  0.000269  0.654989  0.490484  1
  Ta  Ta47  1  0.500195  0.787295  0.501040  1
  Ta  Ta48  1  0.500287  0.619907  0.528060  1
  Ta  Ta49  1  1.000089  0.850578  0.586948  1
  Ta  Ta50  1  0.500165  0.952779  0.472269  1
  Ta  Ta51  1  0.500409  0.452973  0.556435  1
  Ta  Ta52  1  1.000184  0.556343  0.442457  1
  Ta  Ta53  1  0.251216  0.136476  0.443182  1
  Ta  Ta54  1  0.248941  0.952795  0.533875  1
  Ta  Ta55  1  0.249205  0.453647  0.495403  1
  Ta  Ta56  1  0.251254  0.769518  0.442571  1
  Ta  Ta57  1  0.751290  0.952793  0.533876  1
  Ta  Ta58  1  0.749308  0.769528  0.442548  1
  Ta  Ta59  1  0.749268  0.136466  0.443147  1
  Ta  Ta60  1  0.751327  0.453653  0.495402  1
  Ta  Ta61  1  0.500037  0.953043  0.587049  1
  Ta  Ta62  1  0.000536  0.452827  0.585510  1
  Ta  Ta63  1  0.500229  0.789426  0.614815  1
  Ta  Ta64  1  0.999615  0.553252  0.631784  1
  Ta  Ta65  1  0.999939  0.853394  0.685544  1
  Ta  Ta66  1  0.500404  0.608992  0.700806  1
  Ta  Ta67  1  0.999545  0.352604  0.631790  1
  Ta  Ta68  1  0.998750  0.050089  0.685457  1
  Ta  Ta69  1  0.499956  0.116624  0.615110  1
  Ta  Ta70  1  0.495291  0.303888  0.702738  1
  Ta  Ta71  1  0.500771  0.617941  0.644230  1
  Ta  Ta72  1  0.000382  0.646639  0.681946  1
  Ta  Ta73  1  0.000341  0.753699  0.635824  1
  Ta  Ta74  1  0.500124  0.782652  0.671269  1
  Ta  Ta75  1  0.997057  0.257484  0.681511  1
  Ta  Ta76  1  0.999872  0.151298  0.635728  1
  Ta  Ta77  1  0.499873  0.288066  0.645110  1
  Ta  Ta78  1  0.498207  0.123595  0.671826  1
  Ta  Ta79  1  0.012776  0.379068  0.720422  1
  Ta  Ta80  1  0.500651  0.452310  0.614310  1
  Ta  Ta81  1  0.499480  0.952288  0.694028  1
  Ta  Ta82  1  1.000032  0.054996  0.586952  1
  Ta  Ta83  1  0.251364  0.637572  0.585927  1
  Ta  Ta84  1  0.253970  0.454121  0.673815  1
  Ta  Ta85  1  0.246618  0.952644  0.640097  1
  Ta  Ta86  1  0.251211  0.268080  0.586035  1
  Ta  Ta87  1  0.748836  0.453316  0.674452  1
  Ta  Ta88  1  0.749067  0.268059  0.586010  1
  Ta  Ta89  1  0.749250  0.637616  0.585890  1
  Ta  Ta90  1  0.753027  0.952644  0.640103  1
