# generated using pymatgen
data_Ta6VFe6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.89433168
_cell_length_b   4.89433111
_cell_length_c   9.45058028
_cell_angle_alpha   74.99263015
_cell_angle_beta   74.99262979
_cell_angle_gamma   60.00000107
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta6VFe6
_chemical_formula_sum   'Ta6 V1 Fe6'
_cell_volume   187.08508303
_cell_formula_units_Z   1
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  Ta0  1  0.83408919  0.83408919  0.49773442  1.0
  Ta  Ta1  1  0.16591081  0.16591081  0.50226558  1.0
  Ta  Ta2  1  0.65197478  0.65197478  0.04407467  1.0
  Ta  Ta3  1  0.34802522  0.34802522  0.95592533  1.0
  Ta  Ta4  1  0.54857617  0.54857617  0.35427250  1.0
  Ta  Ta5  1  0.45142383  0.45142383  0.64572750  1.0
  V  V6  1  0.00000000  0.00000000  0.00000000  1.0
  Fe  Fe7  1  0.90587497  0.90587497  0.77469837  1.0
  Fe  Fe8  1  0.41355069  0.90587497  0.77469837  1.0
  Fe  Fe9  1  0.90587497  0.41355069  0.77469837  1.0
  Fe  Fe10  1  0.09412503  0.09412503  0.22530163  1.0
  Fe  Fe11  1  0.58644931  0.09412503  0.22530163  1.0
  Fe  Fe12  1  0.09412503  0.58644931  0.22530163  1.0