data_LaSiRu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.86
_cell_length_b   5.86
_cell_length_c   5.86
_cell_angle_alpha   40.08
_cell_angle_beta   40.08
_cell_angle_gamma   40.08
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaSiRu2
_chemical_formula_sum   'La1 Si1 Ru2'
_cell_volume   75.17
_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  0.0  0.07  1.0
  Si  Si3  1  0.0  0.0  0.0  1.0
  Ru  Ru1  1  0.0  0.0  0.63  1.0
  Ru  Ru2  1  0.0  0.0  0.51  1.0

data_LaSiRu2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.96
_cell_length_b   4.02
_cell_length_c   5.86
_cell_angle_alpha   90.0
_cell_angle_beta   113.31
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   LaSiRu2
_chemical_formula_sum   'La2 Si2 Ru4'
_cell_volume   150.33
_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+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.93  1.0
  Si  Si1  2  0.0  0.0  0.0  1.0
  Ru  Ru2  2  -0.0  0.0  0.49  1.0
  Ru  Ru3  2  -0.0  0.0  0.37  1.0

La Si Ru Ru
La Si Ru Ru 0 1 o o o 2 3 o o o 