data_SrCuTeF
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.28
_cell_length_b   4.28
_cell_length_c   9.22
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrCuTeF
_chemical_formula_sum   'Sr2 Cu2 Te2 F2'
_cell_volume   168.64
_cell_formula_units_Z   2
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  0.14  0.86  1.0
  Sr  Sr1  1  0.14  0.0  0.36  1.0
  Cu  Cu2  1  0.14  0.14  0.61  1.0
  Cu  Cu3  1  0.0  0.0  0.61  1.0
  Te  Te4  1  0.0  0.14  0.01  1.0
  Te  Te5  1  0.14  0.0  0.21  1.0
  F  F6  1  0.14  0.14  0.0  1.0
  F  F7  1  0.0  0.0  0.0  1.0

data_SrCuTeF
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.05
_cell_length_b   6.05
_cell_length_c   9.22
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   SrCuTeF
_chemical_formula_sum   'Sr4 Cu4 Te4 F4'
_cell_volume   337.27
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.86  1.0
  Sr  Sr1  2  0.14  0.0  0.36  1.0
  Cu  Cu2  4  0.07  0.07  0.61  1.0
  Te  Te3  2  0.0  0.0  0.01  1.0
  Te  Te4  2  0.14  0.0  0.21  1.0
  F  F5  4  0.07  0.07  0.0  1.0

Sr Sr Cu Cu Te Te F F