data_YZr2Co
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.25
_cell_length_b   3.25
_cell_length_c   8.14
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   91.51
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YZr2Co
_chemical_formula_sum   'Y1 Zr2 Co1'
_cell_volume   86.18
_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  Y1  1  0.27  0.0  0.45  1.0
  Zr  Zr2  1  0.0  0.0  0.87  1.0
  Zr  Zr3  1  0.27  0.0  0.73  1.0
  Co  Co0  1  0.0  0.0  0.31  1.0

data_YZr2Co
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.25
_cell_length_b   3.25
_cell_length_c   8.14
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   YZr2Co
_chemical_formula_sum   'Y1 Zr2 Co1'
_cell_volume   86.21
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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  0.27  0.0  0.45  1.0
  Zr  Zr1  1  0.0  0.0  0.87  1.0
  Zr  Zr2  1  0.27  0.0  0.73  1.0
  Co  Co3  1  0.0  0.0  0.31  1.0

Y Zr Zr Co