data_Ti4Co
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.25
_cell_length_b   5.25
_cell_length_c   5.25
_cell_angle_alpha   94.89
_cell_angle_beta   94.89
_cell_angle_gamma   146.06
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti4Co
_chemical_formula_sum   'Ti4 Co1'
_cell_volume   77.2
_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  Ti1  1  0.93  0.56  0.0  1.0
  Ti  Ti2  1  0.62  0.99  0.53  1.0
  Ti  Ti3  1  0.99  0.38  0.53  1.0
  Ti  Ti4  1  0.56  0.17  0.0  1.0
  Co  Co0  1  0.0  0.0  0.0  1.0

data_Ti4Co
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.06
_cell_length_b   5.25
_cell_length_c   5.25
_cell_angle_alpha   85.11
_cell_angle_beta   73.03
_cell_angle_gamma   73.03
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti4Co
_chemical_formula_sum   'Ti4 Co1'
_cell_volume   77.2
_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  0.17  0.39  0.0  1.0
  Ti  Ti1  1  0.38  0.61  0.47  1.0
  Ti  Ti2  1  0.56  0.37  0.0  1.0
  Ti  Ti3  1  0.99  0.63  0.47  1.0
  Co  Co4  1  0.0  0.0  0.0  1.0

Ti Ti Ti Ti Co