data_YB4Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.98
_cell_length_b   11.57
_cell_length_c   3.57
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YB4Os
_chemical_formula_sum   'Y4 B16 Os4'
_cell_volume   246.94
_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  Y0  1  0.76  0.52  0.79  1.0
  Y  Y1  1  0.22  0.05  0.79  1.0
  Y  Y2  1  0.77  0.83  0.79  1.0
  Y  Y3  1  0.21  0.73  0.79  1.0
  B  B4  1  0.83  1.0  0.0  1.0
  B  B5  1  0.15  0.57  0.0  1.0
  B  B6  1  0.84  0.35  0.0  1.0
  B  B7  1  0.14  0.21  0.0  1.0
  B  B8  1  0.72  0.42  0.0  1.0
  B  B9  1  0.26  0.15  0.0  1.0
  B  B10  1  0.73  0.93  0.0  1.0
  B  B11  1  0.25  0.64  0.0  1.0
  B  B12  1  0.16  0.22  0.0  1.0
  B  B13  1  0.82  0.35  0.0  1.0
  B  B14  1  0.17  0.13  0.0  1.0
  B  B15  1  0.8  0.43  0.0  1.0
  B  B16  1  0.31  0.32  0.0  1.0
  B  B17  1  0.67  0.25  0.0  1.0
  B  B18  1  0.32  0.03  0.0  1.0
  B  B19  1  0.66  0.54  0.0  1.0
  Os  Os20  1  0.83  0.49  0.79  1.0
  Os  Os21  1  0.15  0.08  0.79  1.0
  Os  Os22  1  0.84  0.86  0.79  1.0
  Os  Os23  1  0.14  0.7  0.79  1.0

data_YB4Os
_symmetry_space_group_name_H-M   P2
_cell_length_a   5.98
_cell_length_b   3.57
_cell_length_c   11.57
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   3
_chemical_formula_structural   YB4Os
_chemical_formula_sum   'Y4 B16 Os4'
_cell_volume   246.94
_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  0.27  0.21  0.23  1.0
  Y  Y1  2  0.28  0.21  0.55  1.0
  B  B2  2  0.17  -0.0  0.25  1.0
  B  B3  2  0.18  -0.0  0.96  1.0
  B  B4  2  0.23  -0.0  0.14  1.0
  B  B5  2  0.24  -0.0  0.65  1.0
  B  B6  2  0.32  -0.0  0.15  1.0
  B  B7  2  0.33  -0.0  0.07  1.0
  B  B8  2  0.34  -0.0  0.71  1.0
  B  B9  2  0.35  -0.0  0.07  1.0
  Os  Os10  2  0.34  0.21  0.2  1.0
  Os  Os11  2  0.35  0.21  0.58  1.0

Y Y Y Y B B B B B B B B B B B B B B B B Os Os Os Os
Y Y Y Y B B B B B B B B B B B B B B B B Os Os Os Os 0 20 o o o 0 19 o o + 1 21 o o o 1 18 o o + 2 22 o o o 3 23 o o o 4 10 o o o 5 11 o o o 6 13 o o o 6 17 o o o 7 12 o o o 7 16 o o o 8 15 o o o 9 14 o o o 12 16 o o o 13 17 o o o 