data_BaReW2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.08
_cell_length_b   6.08
_cell_length_c   6.08
_cell_angle_alpha   151.58
_cell_angle_beta   126.11
_cell_angle_gamma   62.04
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaReW2
_chemical_formula_sum   'Ba1 Re1 W2'
_cell_volume   85.69
_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  0.0  0.0  0.0  1.0
  Re  Re1  1  0.0  0.0  0.21  1.0
  W  W2  1  0.49  0.0  0.07  1.0
  W  W3  1  0.0  0.75  0.14  1.0

data_BaReW2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.98
_cell_length_b   5.51
_cell_length_c   6.08
_cell_angle_alpha   116.94
_cell_angle_beta   104.21
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaReW2
_chemical_formula_sum   'Ba1 Re1 W2'
_cell_volume   85.69
_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  0.0  0.0  0.0  1.0
  Re  Re1  1  0.79  0.79  0.79  1.0
  W  W2  1  0.42  0.93  0.42  1.0
  W  W3  1  0.86  0.61  0.61  1.0

Ba Re W W