data_SrCoPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.38
_cell_length_b   4.38
_cell_length_c   5.79
_cell_angle_alpha   110.89
_cell_angle_beta   110.89
_cell_angle_gamma   57.9
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrCoPd2
_chemical_formula_sum   'Sr1 Co1 Pd2'
_cell_volume   85.7
_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  0.69  0.0  0.7  1.0
  Co  Co0  1  0.15  0.0  0.98  1.0
  Pd  Pd1  1  0.28  0.0  0.94  1.0
  Pd  Pd2  1  0.12  0.0  0.59  1.0

data_SrCoPd2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.24
_cell_length_b   4.38
_cell_length_c   5.79
_cell_angle_alpha   110.89
_cell_angle_beta   90.0
_cell_angle_gamma   118.95
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrCoPd2
_chemical_formula_sum   'Sr1 Co1 Pd2'
_cell_volume   85.7
_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  0.31  0.3  1.0
  Co  Co1  1  0.0  0.85  0.02  1.0
  Pd  Pd2  1  0.0  0.72  0.06  1.0
  Pd  Pd3  1  0.0  0.88  0.41  1.0

Sr Co Pd Pd