data_YGaTe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.92
_cell_length_b   4.95
_cell_length_c   5.63
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YGaTe2
_chemical_formula_sum   'Y1 Ga1 Te2'
_cell_volume   109.28
_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
  Y  Y3  1  0.0  0.48  0.82  1.0
  Ga  Ga0  1  0.0  0.0  0.0  1.0
  Te  Te1  1  0.96  0.0  0.82  1.0
  Te  Te2  1  0.96  0.48  0.0  1.0

data_YGaTe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.92
_cell_length_b   4.95
_cell_length_c   5.63
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YGaTe2
_chemical_formula_sum   'Y1 Ga1 Te2'
_cell_volume   109.28
_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
  Y  Y0  1  -0.0  0.48  0.82  1.0
  Ga  Ga1  1  0.0  0.0  0.0  1.0
  Te  Te2  1  0.96  0.0  0.82  1.0
  Te  Te3  1  0.96  0.48  0.0  1.0

Y Ga Te Te
Y Ga Te Te 0 3 - o + 1 2 - o - 