data_YNbRe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.59
_cell_length_b   7.35
_cell_length_c   3.02
_cell_angle_alpha   82.8
_cell_angle_beta   73.98
_cell_angle_gamma   23.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YNbRe
_chemical_formula_sum   'Y1 Nb1 Re1'
_cell_volume   59.97
_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  0.67  0.51  0.65  1.0
  Nb  Nb0  1  0.67  0.51  0.28  1.0
  Re  Re1  1  0.67  0.51  0.39  1.0

data_YNbRe
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.33
_cell_length_b   14.32
_cell_length_c   3.02
_cell_angle_alpha   90.0
_cell_angle_beta   123.55
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   YNbRe
_chemical_formula_sum   'Y2 Nb2 Re2'
_cell_volume   119.94
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  0.01  0.5  0.68  1.0
  Nb  Nb1  2  0.01  0.5  0.06  1.0
  Re  Re2  2  0.01  0.5  0.95  1.0

Y Nb Re
Y Nb Re 0 2 o o o 1 2 o o o 