data_Zr2AgBi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.5
_cell_length_b   5.5
_cell_length_c   5.45
_cell_angle_alpha   103.9
_cell_angle_beta   103.9
_cell_angle_gamma   35.19
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2AgBi
_chemical_formula_sum   'Zr2 Ag1 Bi1'
_cell_volume   91.85
_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
  Zr  Zr2  1  0.57  0.0  0.03  1.0
  Zr  Zr3  1  0.53  0.0  0.24  1.0
  Ag  Ag0  1  0.0  0.0  0.0  1.0
  Bi  Bi1  1  0.55  0.0  0.64  1.0

data_Zr2AgBi
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.32
_cell_length_b   5.45
_cell_length_c   5.5
_cell_angle_alpha   103.9
_cell_angle_beta   107.59
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2AgBi
_chemical_formula_sum   'Zr2 Ag1 Bi1'
_cell_volume   91.85
_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
  Zr  Zr0  1  0.0  0.03  0.57  1.0
  Zr  Zr1  1  0.0  0.24  0.53  1.0
  Ag  Ag2  1  0.0  0.0  0.0  1.0
  Bi  Bi3  1  0.0  0.64  0.55  1.0

Zr Zr Ag Bi