data_HfGaAs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.68
_cell_length_b   3.9
_cell_length_c   5.64
_cell_angle_alpha   90.0
_cell_angle_beta   108.6
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfGaAs2
_chemical_formula_sum   'Hf1 Ga1 As2'
_cell_volume   76.63
_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
  Hf  Hf3  1  0.22  0.95  0.24  1.0
  Ga  Ga2  1  0.33  0.0  0.08  1.0
  As  As0  1  0.37  0.0  0.99  1.0
  As  As1  1  0.09  0.95  0.05  1.0

data_HfGaAs2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.68
_cell_length_b   3.9
_cell_length_c   5.64
_cell_angle_alpha   90.0
_cell_angle_beta   108.6
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfGaAs2
_chemical_formula_sum   'Hf1 Ga1 As2'
_cell_volume   76.63
_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
  Hf  Hf0  1  0.22  0.95  0.24  1.0
  Ga  Ga1  1  0.33  0.0  0.08  1.0
  As  As2  1  0.09  0.95  0.05  1.0
  As  As3  1  0.37  0.0  0.99  1.0

Hf Ga As As