[CIF]
data_CaScGa
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.52202494
_cell_length_b   3.52202494
_cell_length_c   7.41178992
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaScGa
_chemical_formula_sum   'Ca1 Sc1 Ga1'
_cell_volume   79.62300914
_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
  Ca  Ca0  1  0.00000000  0.00000000  0.24332891  1
  Ga  Ga1  1  1.76101247  1.01672102  2.58650760  1
  Sc  Sc2  1  -0.00000000  2.03344205  4.58195348  1
[/CIF]
