data_SrGaPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.81
_cell_length_b   4.81
_cell_length_c   4.81
_cell_angle_alpha   118.99
_cell_angle_beta   118.99
_cell_angle_gamma   91.76
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrGaPd2
_chemical_formula_sum   'Sr1 Ga1 Pd2'
_cell_volume   80.07
_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
  Sr  Sr3  1  0.0  0.0  0.35  1.0
  Ga  Ga0  1  0.0  0.0  0.0  1.0
  Pd  Pd1  1  0.44  0.0  0.68  1.0
  Pd  Pd2  1  0.0  0.44  0.68  1.0

data_SrGaPd2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.7
_cell_length_b   6.91
_cell_length_c   4.81
_cell_angle_alpha   90.0
_cell_angle_beta   134.12
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   SrGaPd2
_chemical_formula_sum   'Sr2 Ga2 Pd4'
_cell_volume   160.15
_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
  Sr  Sr0  2  0.0  0.0  0.65  1.0
  Ga  Ga1  2  0.0  0.0  0.0  1.0
  Pd  Pd2  4  0.28  0.28  0.32  1.0

Sr Ga Pd Pd
Sr Ga Pd Pd 0 3 o o o 0 1 o o o 0 2 o o o 