data_AlTe2As
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.26
_cell_length_b   8.26
_cell_length_c   8.26
_cell_angle_alpha   152.34
_cell_angle_beta   152.34
_cell_angle_gamma   39.52
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlTe2As
_chemical_formula_sum   'Al1 Te2 As1'
_cell_volume   121.28
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  Te  Te2  1  0.0  0.0  0.77  1.0
  Te  Te3  1  0.0  0.97  0.89  1.0
  As  As1  1  0.97  0.0  0.89  1.0

data_AlTe2As
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.95
_cell_length_b   3.95
_cell_length_c   8.26
_cell_angle_alpha   103.83
_cell_angle_beta   103.83
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlTe2As
_chemical_formula_sum   'Al1 Te2 As1'
_cell_volume   121.28
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  Te  Te1  1  0.09  0.97  0.09  1.0
  Te  Te2  1  0.23  0.0  0.23  1.0
  As  As3  1  0.11  0.0  0.09  1.0

Al Te Te As