data_Y2IrW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.89
_cell_length_b   4.89
_cell_length_c   5.91
_cell_angle_alpha   98.7
_cell_angle_beta   98.7
_cell_angle_gamma   37.07
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y2IrW
_chemical_formula_sum   'Y2 Ir1 W1'
_cell_volume   84.08
_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
  Y  Y2  1  0.54  0.0  0.33  1.0
  Y  Y3  1  0.79  0.0  0.5  1.0
  Ir  Ir0  1  0.17  0.0  0.92  1.0
  W  W1  1  0.0  0.0  0.0  1.0

data_Y2IrW
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.11
_cell_length_b   4.89
_cell_length_c   5.91
_cell_angle_alpha   98.7
_cell_angle_beta   90.0
_cell_angle_gamma   108.54
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y2IrW
_chemical_formula_sum   'Y2 Ir1 W1'
_cell_volume   84.08
_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
  Y  Y0  1  0.0  0.21  0.5  1.0
  Y  Y1  1  0.0  0.46  0.67  1.0
  Ir  Ir2  1  0.0  0.83  0.08  1.0
  W  W3  1  0.0  0.0  0.0  1.0

Y Y Ir W