data_Sr2AsPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.21
_cell_length_b   6.21
_cell_length_c   4.51
_cell_angle_alpha   102.45
_cell_angle_beta   102.45
_cell_angle_gamma   40.09
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2AsPd
_chemical_formula_sum   'Sr2 As1 Pd1'
_cell_volume   109.18
_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  Sr2  1  0.45  0.0  0.33  1.0
  Sr  Sr3  1  0.17  0.0  0.98  1.0
  As  As0  1  0.63  0.0  0.69  1.0
  Pd  Pd1  1  0.38  0.0  0.59  1.0

data_Sr2AsPd
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.26
_cell_length_b   4.51
_cell_length_c   6.21
_cell_angle_alpha   102.45
_cell_angle_beta   110.05
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2AsPd
_chemical_formula_sum   'Sr2 As1 Pd1'
_cell_volume   109.18
_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  Sr0  1  0.0  0.33  0.45  1.0
  Sr  Sr1  1  0.0  0.98  0.17  1.0
  As  As2  1  0.0  0.69  0.63  1.0
  Pd  Pd3  1  0.0  0.59  0.38  1.0

Sr Sr As Pd