data_BaY2Pt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.87
_cell_length_b   6.87
_cell_length_c   6.87
_cell_angle_alpha   148.74
_cell_angle_beta   128.68
_cell_angle_gamma   61.33
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaY2Pt
_chemical_formula_sum   'Ba1 Y2 Pt1'
_cell_volume   130.09
_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
  Y  Y2  1  0.85  0.0  0.72  1.0
  Y  Y3  1  0.0  0.97  0.19  1.0
  Pt  Pt1  1  0.0  0.0  0.91  1.0

data_BaY2Pt
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.7
_cell_length_b   5.95
_cell_length_c   6.87
_cell_angle_alpha   115.66
_cell_angle_beta   105.63
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaY2Pt
_chemical_formula_sum   'Ba1 Y2 Pt1'
_cell_volume   130.09
_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
  Y  Y1  1  0.13  0.28  0.13  1.0
  Y  Y2  1  0.81  0.79  0.79  1.0
  Pt  Pt3  1  0.09  0.09  0.09  1.0

Ba Y Y Pt