data_KBaGa
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.3
_cell_length_b   8.3
_cell_length_c   8.3
_cell_angle_alpha   150.76
_cell_angle_beta   150.76
_cell_angle_gamma   41.82
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KBaGa
_chemical_formula_sum   'K1 Ba1 Ga1'
_cell_volume   135.88
_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
  K  K2  1  0.0  0.0  0.82  1.0
  Ba  Ba0  1  0.0  0.0  0.79  1.0
  Ga  Ga1  1  0.0  0.0  0.39  1.0

data_KBaGa
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.92
_cell_length_b   5.92
_cell_length_c   8.3
_cell_angle_alpha   90.0
_cell_angle_beta   110.91
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   KBaGa
_chemical_formula_sum   'K2 Ba2 Ga2'
_cell_volume   271.77
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  K  K0  2  0.0  0.0  0.18  1.0
  Ba  Ba1  2  0.0  0.0  0.21  1.0
  Ga  Ga2  2  0.0  0.0  0.61  1.0

K Ba Ga
K Ba Ga 0 1 o o o 0 2 o o o 1 2 o o o 2 2 + o + 2 2 o + + 