data_BaAsW2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.56
_cell_length_b   4.56
_cell_length_c   6.95
_cell_angle_alpha   99.13
_cell_angle_beta   99.13
_cell_angle_gamma   43.26
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaAsW2
_chemical_formula_sum   'Ba1 As1 W2'
_cell_volume   97.67
_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  Ba1  1  0.16  0.0  0.78  1.0
  As  As0  1  0.64  0.0  0.09  1.0
  W  W2  1  0.23  0.0  0.08  1.0
  W  W3  1  0.21  0.0  0.18  1.0

data_BaAsW2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.36
_cell_length_b   4.56
_cell_length_c   6.95
_cell_angle_alpha   99.13
_cell_angle_beta   90.0
_cell_angle_gamma   111.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaAsW2
_chemical_formula_sum   'Ba1 As1 W2'
_cell_volume   97.67
_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  0.84  0.22  1.0
  As  As1  1  0.0  0.36  0.91  1.0
  W  W2  1  0.0  0.77  0.92  1.0
  W  W3  1  0.0  0.79  0.82  1.0

Ba As W W