data_YScCo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.98
_cell_length_b   5.98
_cell_length_c   5.98
_cell_angle_alpha   148.35
_cell_angle_beta   139.08
_cell_angle_gamma   52.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YScCo2
_chemical_formula_sum   'Y1 Sc1 Co2'
_cell_volume   73.04
_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
  Y  Y3  1  0.63  0.0  0.92  1.0
  Sc  Sc2  1  0.0  0.0  0.67  1.0
  Co  Co0  1  0.0  0.0  0.78  1.0
  Co  Co1  1  0.0  0.09  0.07  1.0

data_YScCo2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.26
_cell_length_b   4.18
_cell_length_c   5.98
_cell_angle_alpha   110.46
_cell_angle_beta   105.82
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YScCo2
_chemical_formula_sum   'Y1 Sc1 Co2'
_cell_volume   73.04
_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
  Y  Y0  1  0.0  0.92  0.29  1.0
  Sc  Sc1  1  0.0  0.67  0.67  1.0
  Co  Co2  1  0.0  0.78  0.78  1.0
  Co  Co3  1  0.91  0.98  0.98  1.0

Y Sc Co Co