data_[Ta5Te7]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ta  1.5000  1.4500  0.8200
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P2]
_cell_length_a [6.5205]
_cell_length_b [19.9233]
_cell_length_c [7.1099]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.6175]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [3]
_chemical_formula_structural [Ta5Te7]
_chemical_formula_sum '[Ta5 Te7]'
_cell_volume [913.2180]
_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  2  0.1307  0.5163  0.6855  1
  Ta  Ta1  1  0.0000  0.4003  0.5000  1
  Ta  Ta2  1  0.5000  0.5074  0.0000  1
  Ta  Ta3  1  0.5000  0.5492  0.5000  1
  Te  Te4  2  0.2712  0.3849  0.8301  1
  Te  Te5  2  0.2859  0.4517  0.2998  1
  Te  Te6  2  0.3941  0.6320  0.7667  1
  Te  Te7  1  0.0000  0.5732  0.0000  1
]