data_BaSrY
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.21
_cell_length_b   9.21
_cell_length_c   9.21
_cell_angle_alpha   154.59
_cell_angle_beta   154.59
_cell_angle_gamma   36.24
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaSrY
_chemical_formula_sum   'Ba1 Sr1 Y1'
_cell_volume   143.89
_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  0.22  1.0
  Sr  Sr1  1  0.0  0.0  0.59  1.0
  Y  Y2  1  0.0  0.0  0.7  1.0

data_BaSrY
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.73
_cell_length_b   5.73
_cell_length_c   9.21
_cell_angle_alpha   90.0
_cell_angle_beta   108.12
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   BaSrY
_chemical_formula_sum   'Ba2 Sr2 Y2'
_cell_volume   287.77
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.22  0.0  0.22  1.0
  Sr  Sr1  2  0.09  0.5  0.59  1.0
  Y  Y2  2  0.2  0.5  0.7  1.0

Ba Sr Y