data_TiCoGe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.85
_cell_length_b   3.89
_cell_length_c   5.28
_cell_angle_alpha   90.0
_cell_angle_beta   92.89
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiCoGe2
_chemical_formula_sum   'Ti1 Co1 Ge2'
_cell_volume   58.49
_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
  Ti  Ti3  1  0.0  0.0  0.0  1.0
  Co  Co0  1  0.29  0.0  0.64  1.0
  Ge  Ge1  1  0.01  0.94  0.93  1.0
  Ge  Ge2  1  0.57  0.94  0.34  1.0

data_TiCoGe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.85
_cell_length_b   3.89
_cell_length_c   5.28
_cell_angle_alpha   90.0
_cell_angle_beta   92.89
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiCoGe2
_chemical_formula_sum   'Ti1 Co1 Ge2'
_cell_volume   58.49
_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
  Ti  Ti0  1  0.0  0.0  0.0  1.0
  Co  Co1  1  0.29  0.0  0.64  1.0
  Ge  Ge2  1  0.01  0.94  0.93  1.0
  Ge  Ge3  1  0.57  0.94  0.34  1.0

Ti Co Ge Ge