data_AlTcTe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.96
_cell_length_b   4.96
_cell_length_c   3.32
_cell_angle_alpha   94.1
_cell_angle_beta   94.1
_cell_angle_gamma   94.14
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlTcTe2
_chemical_formula_sum   'Al1 Tc1 Te2'
_cell_volume   81.03
_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
  Tc  Tc1  1  0.38  0.0  0.0  1.0
  Te  Te2  1  0.51  0.19  0.65  1.0
  Te  Te3  1  0.51  0.81  0.65  1.0

data_AlTcTe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.32
_cell_length_b   4.96
_cell_length_c   4.96
_cell_angle_alpha   94.14
_cell_angle_beta   94.1
_cell_angle_gamma   94.1
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlTcTe2
_chemical_formula_sum   'Al1 Tc1 Te2'
_cell_volume   81.03
_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
  Tc  Tc1  1  0.0  0.38  0.0  1.0
  Te  Te2  1  0.65  0.51  0.19  1.0
  Te  Te3  1  0.65  0.51  0.81  1.0

Al Tc Te Te