data_BaY2Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.0
_cell_length_b   7.0
_cell_length_c   3.95
_cell_angle_alpha   106.39
_cell_angle_beta   106.39
_cell_angle_gamma   119.13
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaY2Te
_chemical_formula_sum   'Ba1 Y2 Te1'
_cell_volume   140.54
_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
  Ba  Ba0  1  0.55  0.0  0.0  1.0
  Y  Y2  1  0.77  0.02  0.0  1.0
  Y  Y3  1  0.77  0.98  0.0  1.0
  Te  Te1  1  0.0  0.0  0.0  1.0

data_BaY2Te
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.95
_cell_length_b   5.89
_cell_length_c   7.0
_cell_angle_alpha   65.11
_cell_angle_beta   73.61
_cell_angle_gamma   89.98
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaY2Te
_chemical_formula_sum   'Ba1 Y2 Te1'
_cell_volume   140.54
_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
  Ba  Ba0  1  0.0  0.0  0.55  1.0
  Y  Y1  1  0.02  0.02  0.75  1.0
  Y  Y2  1  0.98  0.98  0.79  1.0
  Te  Te3  1  0.0  0.0  0.0  1.0

Ba Y Y Te