data_YGaNi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.01
_cell_length_b   5.01
_cell_length_c   5.01
_cell_angle_alpha   133.86
_cell_angle_beta   133.86
_cell_angle_gamma   67.3
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YGaNi2
_chemical_formula_sum   'Y1 Ga1 Ni2'
_cell_volume   64.35
_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  0.96  0.0  0.09  1.0
  Ga  Ga0  1  0.0  0.0  0.17  1.0
  Ni  Ni1  1  0.0  0.96  0.09  1.0
  Ni  Ni2  1  0.0  0.0  0.0  1.0

data_YGaNi2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.93
_cell_length_b   3.93
_cell_length_c   5.01
_cell_angle_alpha   113.07
_cell_angle_beta   113.07
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YGaNi2
_chemical_formula_sum   'Y1 Ga1 Ni2'
_cell_volume   64.35
_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  0.09  0.12  0.12  1.0
  Ga  Ga1  1  0.17  0.17  0.17  1.0
  Ni  Ni2  1  0.0  0.0  0.0  1.0
  Ni  Ni3  1  0.12  0.09  0.12  1.0

Y Ga Ni Ni