data_Sr2AsPt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.38
_cell_length_b   5.38
_cell_length_c   3.63
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   94.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2AsPt
_chemical_formula_sum   'Sr2 As1 Pt1'
_cell_volume   104.82
_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  0.83  0.03  0.82  1.0
  Sr  Sr3  1  0.83  0.97  0.82  1.0
  As  As0  1  0.0  0.0  0.0  1.0
  Pt  Pt1  1  0.66  0.0  0.0  1.0

data_Sr2AsPt
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.63
_cell_length_b   5.38
_cell_length_c   5.38
_cell_angle_alpha   94.22
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2AsPt
_chemical_formula_sum   'Sr2 As1 Pt1'
_cell_volume   104.82
_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  0.82  0.83  0.03  1.0
  Sr  Sr1  1  0.82  0.83  0.97  1.0
  As  As2  1  0.0  0.0  0.0  1.0
  Pt  Pt3  1  -0.0  0.66  0.0  1.0

Sr Sr As Pt
Sr Sr As Pt 0 1 o - o 0 2 + o + 0 3 o o + 1 2 + + + 1 3 o + + 