data_Co2HgGe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.8
_cell_length_b   3.38
_cell_length_c   6.55
_cell_angle_alpha   90.0
_cell_angle_beta   91.79
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co2HgGe
_chemical_formula_sum   'Co2 Hg1 Ge1'
_cell_volume   61.96
_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
  Co  Co0  1  0.87  0.0  0.2  1.0
  Co  Co1  1  0.23  0.69  0.05  1.0
  Hg  Hg3  1  0.48  0.69  0.39  1.0
  Ge  Ge2  1  0.51  0.0  0.74  1.0

data_Co2HgGe
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.8
_cell_length_b   3.38
_cell_length_c   6.55
_cell_angle_alpha   90.0
_cell_angle_beta   91.79
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co2HgGe
_chemical_formula_sum   'Co2 Hg1 Ge1'
_cell_volume   61.96
_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
  Co  Co0  1  0.23  0.69  0.05  1.0
  Co  Co1  1  0.87  0.0  0.2  1.0
  Hg  Hg2  1  0.48  0.69  0.39  1.0
  Ge  Ge3  1  0.51  0.0  0.74  1.0

Co Co Hg Ge