data_Sr2CdTe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.77
_cell_length_b   6.77
_cell_length_c   5.02
_cell_angle_alpha   93.37
_cell_angle_beta   93.37
_cell_angle_gamma   38.78
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2CdTe
_chemical_formula_sum   'Sr2 Cd1 Te1'
_cell_volume   143.75
_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
  Sr  Sr1  1  0.82  0.0  0.42  1.0
  Sr  Sr2  1  0.39  0.0  0.85  1.0
  Cd  Cd0  1  0.2  0.0  0.4  1.0
  Te  Te3  1  0.95  0.0  0.86  1.0

data_Sr2CdTe
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.49
_cell_length_b   5.02
_cell_length_c   6.77
_cell_angle_alpha   93.37
_cell_angle_beta   109.39
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2CdTe
_chemical_formula_sum   'Sr2 Cd1 Te1'
_cell_volume   143.75
_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
  Sr  Sr0  1  0.0  0.42  0.82  1.0
  Sr  Sr1  1  0.0  0.85  0.39  1.0
  Cd  Cd2  1  0.0  0.4  0.2  1.0
  Te  Te3  1  0.0  0.86  0.95  1.0

Sr Sr Cd Te
Sr Sr Cd Te 0 2 + o o 0 3 o o o 0 3 o o - 1 2 o o o 1 2 o o + 1 3 - o o 2 3 - o - 2 3 - o o 