data_Sr2CrPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.59
_cell_length_b   6.59
_cell_length_c   5.22
_cell_angle_alpha   111.97
_cell_angle_beta   111.97
_cell_angle_gamma   34.2
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2CrPd
_chemical_formula_sum   'Sr2 Cr1 Pd1'
_cell_volume   117.24
_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  0.33  0.0  0.2  1.0
  Sr  Sr3  1  0.54  0.0  0.55  1.0
  Cr  Cr0  1  0.63  0.0  0.15  1.0
  Pd  Pd1  1  0.33  0.0  0.31  1.0

data_Sr2CrPd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.88
_cell_length_b   5.22
_cell_length_c   6.59
_cell_angle_alpha   111.97
_cell_angle_beta   107.1
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2CrPd
_chemical_formula_sum   'Sr2 Cr1 Pd1'
_cell_volume   117.24
_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  0.2  0.33  1.0
  Sr  Sr1  1  0.0  0.55  0.54  1.0
  Cr  Cr2  1  0.0  0.15  0.63  1.0
  Pd  Pd3  1  0.0  0.31  0.33  1.0

Sr Sr Cr Pd