data_La2ZrAg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.33
_cell_length_b   6.33
_cell_length_c   6.33
_cell_angle_alpha   146.72
_cell_angle_beta   127.46
_cell_angle_gamma   63.62
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2ZrAg
_chemical_formula_sum   'La2 Zr1 Ag1'
_cell_volume   109.43
_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
  La  La1  1  0.81  0.0  0.8  1.0
  La  La2  1  0.0  0.8  0.59  1.0
  Zr  Zr3  1  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.0  0.0  0.38  1.0

data_La2ZrAg
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.63
_cell_length_b   5.61
_cell_length_c   6.33
_cell_angle_alpha   116.27
_cell_angle_beta   106.64
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2ZrAg
_chemical_formula_sum   'La2 Zr1 Ag1'
_cell_volume   109.43
_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
  La  La0  1  0.0  0.8  0.98  1.0
  La  La1  1  0.2  0.78  0.78  1.0
  Zr  Zr2  1  0.0  0.0  0.0  1.0
  Ag  Ag3  1  0.0  0.38  0.38  1.0

La La Zr Ag