data_Nb3B2Ru5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.49
_cell_length_b   9.49
_cell_length_c   3.02
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb3B2Ru5
_chemical_formula_sum   'Nb6 B4 Ru10'
_cell_volume   271.74
_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
  Nb  Nb0  1  0.81  0.41  0.0  1.0
  Nb  Nb1  1  0.67  0.07  0.0  1.0
  Nb  Nb2  1  0.07  0.81  0.0  1.0
  Nb  Nb3  1  0.41  0.67  0.0  1.0
  Nb  Nb4  1  0.74  0.74  0.0  1.0
  Nb  Nb5  1  0.0  0.0  0.0  1.0
  B  B6  1  0.9  0.33  0.0  1.0
  B  B7  1  0.59  0.16  0.0  1.0
  B  B8  1  0.16  0.9  0.0  1.0
  B  B9  1  0.33  0.59  0.0  1.0
  Ru  Ru10  1  0.42  0.82  0.51  1.0
  Ru  Ru11  1  0.07  0.67  0.51  1.0
  Ru  Ru12  1  0.67  0.41  0.51  1.0
  Ru  Ru13  1  0.81  0.08  0.51  1.0
  Ru  Ru14  1  0.67  0.42  0.51  1.0
  Ru  Ru15  1  0.82  0.07  0.51  1.0
  Ru  Ru16  1  0.08  0.67  0.51  1.0
  Ru  Ru17  1  0.41  0.81  0.51  1.0
  Ru  Ru18  1  0.74  0.0  0.51  1.0
  Ru  Ru19  1  0.0  0.74  0.51  1.0

data_Nb3B2Ru5
_symmetry_space_group_name_H-M   Pm
_cell_length_a   9.49
_cell_length_b   3.02
_cell_length_c   9.49
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   Nb3B2Ru5
_chemical_formula_sum   'Nb6 B4 Ru10'
_cell_volume   271.74
_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
  Nb  Nb0  1  0.0  0.0  0.0  1.0
  Nb  Nb1  1  0.07  0.0  0.81  1.0
  Nb  Nb2  1  0.41  0.0  0.67  1.0
  Nb  Nb3  1  0.67  0.0  0.07  1.0
  Nb  Nb4  1  0.74  0.0  0.74  1.0
  Nb  Nb5  1  0.81  0.0  0.41  1.0
  B  B6  1  0.16  0.0  0.9  1.0
  B  B7  1  0.33  0.0  0.59  1.0
  B  B8  1  0.59  0.0  0.16  1.0
  B  B9  1  0.9  0.0  0.33  1.0
  Ru  Ru10  1  0.0  0.5  0.74  1.0
  Ru  Ru11  1  0.07  0.5  0.67  1.0
  Ru  Ru12  1  0.08  0.5  0.67  1.0
  Ru  Ru13  1  0.41  0.5  0.81  1.0
  Ru  Ru14  1  0.42  0.5  0.82  1.0
  Ru  Ru15  1  0.67  0.5  0.42  1.0
  Ru  Ru16  1  0.67  0.5  0.41  1.0
  Ru  Ru17  1  0.74  0.5  0.0  1.0
  Ru  Ru18  1  0.81  0.5  0.08  1.0
  Ru  Ru19  1  0.82  0.5  0.07  1.0

Nb Nb Nb Nb Nb Nb B B B B Ru Ru Ru Ru Ru Ru Ru Ru Ru Ru
Nb Nb Nb Nb Nb Nb B B B B Ru Ru Ru Ru Ru Ru Ru Ru Ru Ru 0 6 o o o 0 4 o o o 1 7 o o o 1 4 o - o 2 8 o o o 2 4 - o o 2 5 o + o 3 9 o o o 3 4 o o o 4 14 o o - 4 14 o o o 4 12 o o - 4 12 o o o 4 17 o o - 4 17 o o o 4 10 o o - 4 10 o o o 4 16 + o - 4 16 + o o 4 11 + o - 4 11 + o o 4 19 + o - 4 19 + o o 4 18 o + - 4 18 o + o 4 15 o + - 4 15 o + o 4 13 o + - 4 13 o + o 4 4 o o + 4 5 + + o 5 8 o - o 10 17 o o o 11 16 o o o 11 19 o o o 12 14 o o o 13 15 o o o 13 18 o o o 15 18 o o o 16 19 o o o 