data_YAgSn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.02
_cell_length_b   5.02
_cell_length_c   5.4
_cell_angle_alpha   107.2
_cell_angle_beta   107.2
_cell_angle_gamma   51.83
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YAgSn2
_chemical_formula_sum   'Y1 Ag1 Sn2'
_cell_volume   100.94
_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  Y3  1  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.62  0.0  0.55  1.0
  Sn  Sn1  1  0.95  0.0  0.55  1.0
  Sn  Sn2  1  0.3  0.0  0.55  1.0

data_YAgSn2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.39
_cell_length_b   5.02
_cell_length_c   5.4
_cell_angle_alpha   107.2
_cell_angle_beta   90.0
_cell_angle_gamma   115.92
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YAgSn2
_chemical_formula_sum   'Y1 Ag1 Sn2'
_cell_volume   100.94
_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  0.0  0.0  1.0
  Ag  Ag1  1  0.0  0.38  0.45  1.0
  Sn  Sn2  1  0.0  0.05  0.45  1.0
  Sn  Sn3  1  0.0  0.7  0.45  1.0

Y Ag Sn Sn