data_TaTe2As
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.85
_cell_length_b   4.85
_cell_length_c   7.21
_cell_angle_alpha   100.95
_cell_angle_beta   100.95
_cell_angle_gamma   43.81
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaTe2As
_chemical_formula_sum   'Ta1 Te2 As1'
_cell_volume   115.14
_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  Ta1  1  0.06  0.0  0.5  1.0
  Te  Te2  1  0.4  0.0  0.62  1.0
  Te  Te3  1  0.42  0.0  0.68  1.0
  As  As0  1  0.41  0.0  0.79  1.0

data_TaTe2As
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.62
_cell_length_b   4.85
_cell_length_c   7.21
_cell_angle_alpha   100.95
_cell_angle_beta   90.0
_cell_angle_gamma   111.9
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaTe2As
_chemical_formula_sum   'Ta1 Te2 As1'
_cell_volume   115.14
_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  0.0  0.94  0.5  1.0
  Te  Te1  1  0.0  0.58  0.32  1.0
  Te  Te2  1  0.0  0.6  0.38  1.0
  As  As3  1  0.0  0.59  0.21  1.0

Ta Te Te As