data_CoSbW2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.88
_cell_length_b   4.88
_cell_length_c   2.98
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   114.97
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoSbW2
_chemical_formula_sum   'Co1 Sb1 W2'
_cell_volume   64.16
_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
  Co  Co0  1  0.0  0.0  0.0  1.0
  Sb  Sb1  1  0.62  0.0  0.0  1.0
  W  W2  1  0.31  0.94  0.49  1.0
  W  W3  1  0.31  0.06  0.49  1.0

data_CoSbW2
_symmetry_space_group_name_H-M   Pm
_cell_length_a   4.88
_cell_length_b   2.98
_cell_length_c   4.88
_cell_angle_alpha   90.0
_cell_angle_beta   114.97
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   CoSbW2
_chemical_formula_sum   'Co1 Sb1 W2'
_cell_volume   64.16
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  Co  Co0  1  0.0  0.0  0.0  1.0
  Sb  Sb1  1  0.62  0.0  0.0  1.0
  W  W2  1  0.31  0.5  0.94  1.0
  W  W3  1  0.31  0.5  0.06  1.0

Co Sb W W
Co Sb W W 0 1 - o o 0 2 o - - 0 2 o - o 0 3 o o - 0 3 o o o 1 2 o - - 1 2 o - o 1 3 o o - 1 3 o o o 2 3 o + o 