data_GaHgSb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.71
_cell_length_b   5.71
_cell_length_c   5.71
_cell_angle_alpha   131.61
_cell_angle_beta   131.61
_cell_angle_gamma   70.84
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaHgSb2
_chemical_formula_sum   'Ga1 Hg1 Sb2'
_cell_volume   102.09
_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
  Ga  Ga0  1  0.0  0.0  0.0  1.0
  Hg  Hg1  1  0.34  0.0  0.33  1.0
  Sb  Sb2  1  0.0  0.0  0.66  1.0
  Sb  Sb3  1  0.0  0.34  0.33  1.0

data_GaHgSb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.68
_cell_length_b   4.68
_cell_length_c   5.71
_cell_angle_alpha   114.19
_cell_angle_beta   114.19
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaHgSb2
_chemical_formula_sum   'Ga1 Hg1 Sb2'
_cell_volume   102.09
_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
  Ga  Ga0  1  0.0  0.0  0.0  1.0
  Hg  Hg1  1  0.67  0.0  0.01  1.0
  Sb  Sb2  1  0.01  0.34  0.01  1.0
  Sb  Sb3  1  0.34  0.0  0.34  1.0

Ga Hg Sb Sb