# generated using pymatgen
data_Ta6Nb(BC)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.14276501
_cell_length_b   3.21752298
_cell_length_c   16.23284304
_cell_angle_alpha   95.68764162
_cell_angle_beta   95.55509090
_cell_angle_gamma   90.00000455
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta6Nb(BC)4
_chemical_formula_sum   'Ta6 Nb1 B4 C4'
_cell_volume   162.56236933
_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  0.08178265  0.08178265  0.16356729  1.0
  Ta  Ta1  1  0.64639154  0.64639054  0.29278308  1.0
  Ta  Ta2  1  0.21401472  0.21401472  0.42803043  1.0
  Ta  Ta3  1  0.78598528  0.78598428  0.57196957  1.0
  Ta  Ta4  1  0.35360846  0.35360846  0.70721692  1.0
  Ta  Ta5  1  0.91821735  0.91821635  0.83643271  1.0
  Nb  Nb6  1  0.50000000  0.00000000  0.00000000  1.0
  B  B7  1  0.02871085  0.52870985  0.05742270  1.0
  B  B8  1  0.55879603  0.55879503  0.11759206  1.0
  B  B9  1  0.44120397  0.44120397  0.88240794  1.0
  B  B10  1  0.97128915  0.47128915  0.94257730  1.0
  C  C11  1  0.14768599  0.14768599  0.29537197  1.0
  C  C12  1  0.71522004  0.71521904  0.43044008  1.0
  C  C13  1  0.28477996  0.28477996  0.56955992  1.0
  C  C14  1  0.85231401  0.85231301  0.70462803  1.0