data_SrV2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.32
_cell_length_b   3.32
_cell_length_c   7.79
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   91.38
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrV2Pd
_chemical_formula_sum   'Sr1 V2 Pd1'
_cell_volume   86.06
_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  Sr1  1  0.0  0.0  0.0  1.0
  V  V2  1  0.32  0.0  0.59  1.0
  V  V3  1  0.32  0.0  0.2  1.0
  Pd  Pd0  1  0.0  0.0  0.9  1.0

data_SrV2Pd
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.32
_cell_length_b   3.32
_cell_length_c   7.79
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   SrV2Pd
_chemical_formula_sum   'Sr1 V2 Pd1'
_cell_volume   86.09
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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  0.0  0.0  1.0
  V  V1  1  0.32  0.0  0.2  1.0
  V  V2  1  0.32  0.0  0.59  1.0
  Pd  Pd3  1  0.0  0.0  0.9  1.0

Sr V V Pd
Sr V V Pd 0 3 o o - 0 1 o o - 0 2 o o o 1 1 o + o 1 1 + o o 1 3 o o o 1 3 + o o 1 2 o o o 