data_TaBe2Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.02
_cell_length_b   8.02
_cell_length_c   8.02
_cell_angle_alpha   22.45
_cell_angle_beta   22.45
_cell_angle_gamma   22.45
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaBe2Te
_chemical_formula_sum   'Ta1 Be2 Te1'
_cell_volume   66.05
_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  Ta2  1  0.0  0.0  0.72  1.0
  Be  Be0  1  0.0  0.0  0.87  1.0
  Be  Be1  1  0.0  0.0  0.58  1.0
  Te  Te3  1  0.0  0.0  0.0  1.0

data_TaBe2Te
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.41
_cell_length_b   3.12
_cell_length_c   8.02
_cell_angle_alpha   90.0
_cell_angle_beta   102.99
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   TaBe2Te
_chemical_formula_sum   'Ta2 Be4 Te2'
_cell_volume   132.11
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  0.0  0.0  0.28  1.0
  Be  Be1  2  0.0  0.0  0.13  1.0
  Be  Be2  2  0.0  0.0  0.42  1.0
  Te  Te3  2  0.0  0.0  0.0  1.0

Ta Be Be Te