data_La2YGe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.74
_cell_length_b   4.74
_cell_length_c   4.99
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2YGe
_chemical_formula_sum   'La2 Y1 Ge1'
_cell_volume   112.3
_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  0.0  0.37  0.5  1.0
  La  La2  1  0.37  0.0  0.5  1.0
  Y  Y3  1  0.37  0.37  0.0  1.0
  Ge  Ge0  1  0.0  0.0  0.0  1.0

data_La2YGe
_symmetry_space_group_name_H-M   Amm2
_cell_length_a   4.99
_cell_length_b   6.71
_cell_length_c   6.71
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   38
_chemical_formula_structural   La2YGe
_chemical_formula_sum   'La4 Y2 Ge2'
_cell_volume   224.59
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-x, -y, z'
  3  '-x, y, z'
  4  'x, -y, z'
  5  'x, y+1/2, z+1/2'
  6  '-x, -y+1/2, z+1/2'
  7  '-x, y+1/2, z+1/2'
  8  'x, -y+1/2, z+1/2'
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  4  0.5  0.19  0.19  1.0
  Y  Y1  2  0.0  0.0  0.37  1.0
  Ge  Ge2  2  0.0  0.0  0.0  1.0

La La Y Ge
La La Y Ge 0 3 o o o 0 3 o o + 0 1 o o o 0 2 o o o 0 2 o o + 1 3 o o o 1 3 o o + 1 2 o o o 1 2 o o + 2 3 o o o 