data_CoBi2W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.18
_cell_length_b   4.18
_cell_length_c   7.22
_cell_angle_alpha   100.67
_cell_angle_beta   100.67
_cell_angle_gamma   49.39
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoBi2W
_chemical_formula_sum   'Co1 Bi2 W1'
_cell_volume   93.58
_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  Co2  1  0.06  0.0  0.02  1.0
  Bi  Bi0  1  0.05  0.0  0.56  1.0
  Bi  Bi1  1  0.71  0.0  0.64  1.0
  W  W3  1  0.35  0.0  0.38  1.0

data_CoBi2W
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.49
_cell_length_b   4.18
_cell_length_c   7.22
_cell_angle_alpha   100.67
_cell_angle_beta   90.0
_cell_angle_gamma   114.7
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoBi2W
_chemical_formula_sum   'Co1 Bi2 W1'
_cell_volume   93.58
_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  0.94  0.98  1.0
  Bi  Bi1  1  0.0  0.29  0.36  1.0
  Bi  Bi2  1  0.0  0.95  0.44  1.0
  W  W3  1  0.0  0.65  0.62  1.0

Co Bi Bi W
Co Bi Bi W 0 1 o o - 0 2 - o - 0 3 o o o 1 2 - o o 1 3 o o o 2 3 o o o 