data_BaSrW2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.03
_cell_length_b   5.52
_cell_length_c   6.98
_cell_angle_alpha   90.0
_cell_angle_beta   91.73
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaSrW2
_chemical_formula_sum   'Ba1 Sr1 W2'
_cell_volume   116.63
_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
  Ba  Ba0  1  0.89  0.0  0.49  1.0
  Sr  Sr1  1  0.0  0.0  0.0  1.0
  W  W2  1  0.88  0.76  0.12  1.0
  W  W3  1  0.94  0.76  0.86  1.0

data_BaSrW2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.03
_cell_length_b   5.52
_cell_length_c   6.98
_cell_angle_alpha   90.0
_cell_angle_beta   91.73
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaSrW2
_chemical_formula_sum   'Ba1 Sr1 W2'
_cell_volume   116.63
_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
  Ba  Ba0  1  0.89  0.0  0.49  1.0
  Sr  Sr1  1  0.0  0.0  0.0  1.0
  W  W2  1  0.88  0.76  0.12  1.0
  W  W3  1  0.94  0.76  0.86  1.0

Ba Sr W W