data_YGaNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.88
_cell_length_b   4.31
_cell_length_c   7.27
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YGaNi
_chemical_formula_sum   'Y4 Ga4 Ni4'
_cell_volume   215.73
_cell_formula_units_Z   4
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  Y8  1  0.77  0.08  0.44  1.0
  Y  Y9  1  0.56  0.23  0.08  1.0
  Y  Y10  1  0.12  0.23  0.83  1.0
  Y  Y11  1  0.33  0.08  0.19  1.0
  Ga  Ga0  1  0.63  0.08  0.23  1.0
  Ga  Ga1  1  0.69  0.23  0.59  1.0
  Ga  Ga2  1  0.25  0.23  0.04  1.0
  Ga  Ga3  1  0.19  0.08  0.68  1.0
  Ni  Ni4  1  0.4  0.08  0.28  1.0
  Ni  Ni5  1  0.04  0.23  0.65  1.0
  Ni  Ni6  1  0.48  0.23  0.99  1.0
  Ni  Ni7  1  0.85  0.08  0.62  1.0

data_YGaNi
_symmetry_space_group_name_H-M   P-1
_cell_length_a   4.31
_cell_length_b   6.88
_cell_length_c   7.27
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   YGaNi
_chemical_formula_sum   'Y4 Ga4 Ni4'
_cell_volume   215.73
_cell_formula_units_Z   4
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  0.42  0.38  0.56  1.0
  Y  Y1  2  0.42  0.83  0.81  1.0
  Ga  Ga2  2  0.42  0.25  0.04  1.0
  Ga  Ga3  2  0.42  0.69  0.59  1.0
  Ni  Ni4  2  0.42  0.9  0.99  1.0
  Ni  Ni5  2  0.42  0.46  0.65  1.0

Y Y Y Y Ga Ga Ga Ga Ni Ni Ni Ni