data_YNbIn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.83
_cell_length_b   5.83
_cell_length_c   5.83
_cell_angle_alpha   147.19
_cell_angle_beta   138.99
_cell_angle_gamma   53.48
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YNbIn
_chemical_formula_sum   'Y1 Nb1 In1'
_cell_volume   69.93
_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  Y2  1  0.0  0.0  0.98  1.0
  Nb  Nb1  1  0.0  0.0  0.59  1.0
  In  In0  1  0.0  0.0  0.25  1.0

data_YNbIn
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.29
_cell_length_b   4.08
_cell_length_c   5.83
_cell_angle_alpha   110.5
_cell_angle_beta   106.4
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YNbIn
_chemical_formula_sum   'Y1 Nb1 In1'
_cell_volume   69.93
_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  0.02  0.02  0.02  1.0
  Nb  Nb1  1  0.41  0.41  0.41  1.0
  In  In2  1  0.75  0.75  0.75  1.0

Y Nb In
Y Nb In 0 2 o o + 0 1 o o o 1 2 o o o 