data_YTe3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.85
_cell_length_b   5.85
_cell_length_c   5.85
_cell_angle_alpha   113.8
_cell_angle_beta   113.8
_cell_angle_gamma   113.8
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTe3
_chemical_formula_sum   'Y1 Te3'
_cell_volume   123.68
_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  0.0  0.0  1.0
  Te  Te0  1  0.55  0.58  0.48  1.0
  Te  Te1  1  0.0  0.83  0.48  1.0
  Te  Te2  1  0.45  0.58  0.48  1.0

data_YTe3
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.45
_cell_length_b   5.85
_cell_length_c   5.85
_cell_angle_alpha   113.8
_cell_angle_beta   104.69
_cell_angle_gamma   104.69
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTe3
_chemical_formula_sum   'Y1 Te3'
_cell_volume   123.68
_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  0.0  0.0  1.0
  Te  Te1  1  0.48  0.03  0.9  1.0
  Te  Te2  1  0.48  0.48  0.65  1.0
  Te  Te3  1  0.48  0.94  0.9  1.0

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