data_Te2WCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.62
_cell_length_b   3.62
_cell_length_c   8.46
_cell_angle_alpha   100.08
_cell_angle_beta   100.08
_cell_angle_gamma   59.38
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Te2WCl
_chemical_formula_sum   'Te2 W1 Cl1'
_cell_volume   93.64
_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
  Te  Te1  1  0.2  0.0  0.95  1.0
  Te  Te2  1  0.39  0.0  0.34  1.0
  W  W3  1  0.3  0.0  0.14  1.0
  Cl  Cl0  1  0.0  0.0  0.0  1.0

data_Te2WCl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.59
_cell_length_b   3.62
_cell_length_c   8.46
_cell_angle_alpha   100.08
_cell_angle_beta   90.0
_cell_angle_gamma   119.69
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Te2WCl
_chemical_formula_sum   'Te2 W1 Cl1'
_cell_volume   93.64
_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
  Te  Te0  1  0.0  0.61  0.66  1.0
  Te  Te1  1  0.0  0.8  0.05  1.0
  W  W2  1  0.0  0.7  0.86  1.0
  Cl  Cl3  1  0.0  0.0  0.0  1.0

Te Te W Cl