data_La2Ag3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.74
_cell_length_b   6.04
_cell_length_c   9.71
_cell_angle_alpha   62.36
_cell_angle_beta   37.75
_cell_angle_gamma   79.89
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2Ag3
_chemical_formula_sum   'La4 Ag6'
_cell_volume   260.08
_cell_formula_units_Z   2
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  La6  1  0.4  0.06  0.72  1.0
  La  La7  1  0.03  0.32  0.72  1.0
  La  La8  1  0.01  0.42  0.25  1.0
  La  La9  1  0.64  0.16  0.25  1.0
  Ag  Ag0  1  0.95  0.2  0.24  1.0
  Ag  Ag1  1  0.49  0.19  0.24  1.0
  Ag  Ag2  1  0.55  0.28  0.76  1.0
  Ag  Ag3  1  0.09  0.29  0.76  1.0
  Ag  Ag4  1  0.22  0.19  0.25  1.0
  Ag  Ag5  1  0.61  0.1  0.77  1.0

data_La2Ag3
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.04
_cell_length_b   6.04
_cell_length_c   8.74
_cell_angle_alpha   100.11
_cell_angle_beta   100.11
_cell_angle_gamma   119.48
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2Ag3
_chemical_formula_sum   'La4 Ag6'
_cell_volume   260.08
_cell_formula_units_Z   2
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  0.06  0.28  0.87  1.0
  La  La1  1  0.16  0.75  0.11  1.0
  La  La2  1  0.32  0.28  0.24  1.0
  La  La3  1  0.42  0.75  0.75  1.0
  Ag  Ag4  1  0.1  0.23  0.63  1.0
  Ag  Ag5  1  0.19  0.76  0.27  1.0
  Ag  Ag6  1  0.19  0.75  0.54  1.0
  Ag  Ag7  1  0.2  0.76  0.81  1.0
  Ag  Ag8  1  0.28  0.24  0.68  1.0
  Ag  Ag9  1  0.29  0.24  0.14  1.0

La La La La Ag Ag Ag Ag Ag Ag
La La La La Ag Ag Ag Ag Ag Ag 0 7 o o o 0 9 o o o 0 6 o o o 1 7 o o o 2 4 - o o 2 8 o o o 3 5 o o o 4 8 + o o 5 8 o o o 6 9 o o o 