data_GaPt2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.46
_cell_length_b   5.46
_cell_length_c   6.27
_cell_angle_alpha   100.21
_cell_angle_beta   100.21
_cell_angle_gamma   30.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaPt2
_chemical_formula_sum   'Ga2 Pt4'
_cell_volume   93.85
_cell_formula_units_Z   2
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
  Ga  Ga0  1  0.29  0.0  1.0  1.0
  Ga  Ga1  1  0.88  0.0  0.29  1.0
  Pt  Pt2  1  0.91  0.0  0.55  1.0
  Pt  Pt3  1  0.93  0.0  0.61  1.0
  Pt  Pt4  1  0.74  0.0  0.2  1.0
  Pt  Pt5  1  0.21  0.0  0.96  1.0

data_GaPt2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.89
_cell_length_b   5.46
_cell_length_c   6.27
_cell_angle_alpha   100.21
_cell_angle_beta   90.0
_cell_angle_gamma   105.34
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaPt2
_chemical_formula_sum   'Ga2 Pt4'
_cell_volume   93.85
_cell_formula_units_Z   2
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
  Ga  Ga0  1  0.0  0.12  0.71  1.0
  Ga  Ga1  1  0.0  0.71  0.0  1.0
  Pt  Pt2  1  0.0  0.07  0.39  1.0
  Pt  Pt3  1  0.0  0.09  0.45  1.0
  Pt  Pt4  1  0.0  0.26  0.8  1.0
  Pt  Pt5  1  0.0  0.79  0.04  1.0

Ga Ga Pt Pt Pt Pt
Ga Ga Pt Pt Pt Pt 0 5 o o o 1 4 o o o 2 3 o o o 