data_Y3Ni2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.23
_cell_length_b   7.23
_cell_length_c   7.23
_cell_angle_alpha   55.37
_cell_angle_beta   55.37
_cell_angle_gamma   55.37
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y3Ni2
_chemical_formula_sum   'Y6 Ni4'
_cell_volume   238.62
_cell_formula_units_Z   2
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  Y4  1  0.26  0.7  0.63  1.0
  Y  Y5  1  0.9  0.24  0.63  1.0
  Y  Y6  1  0.84  0.06  0.63  1.0
  Y  Y7  1  0.16  0.94  0.68  1.0
  Y  Y8  1  0.1  0.76  0.68  1.0
  Y  Y9  1  0.74  0.3  0.68  1.0
  Ni  Ni0  1  0.0  0.0  0.79  1.0
  Ni  Ni1  1  0.0  0.0  0.37  1.0
  Ni  Ni2  1  0.0  0.0  0.94  1.0
  Ni  Ni3  1  0.0  0.0  0.52  1.0

data_Y3Ni2
_symmetry_space_group_name_H-M   P-1
_cell_length_a   6.72
_cell_length_b   6.72
_cell_length_c   7.23
_cell_angle_alpha   62.31
_cell_angle_beta   62.31
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   Y3Ni2
_chemical_formula_sum   'Y6 Ni4'
_cell_volume   238.62
_cell_formula_units_Z   2
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  2  0.06  0.97  0.63  1.0
  Y  Y1  2  0.24  0.97  0.38  1.0
  Y  Y2  2  0.3  0.03  0.43  1.0
  Ni  Ni3  2  0.0  0.13  0.37  1.0
  Ni  Ni4  2  0.0  0.29  0.21  1.0

Y Y Y Y Y Y Ni Ni Ni Ni