data_B5W24
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.52
_cell_length_b   8.52
_cell_length_c   8.52
_cell_angle_alpha   109.47
_cell_angle_beta   109.47
_cell_angle_gamma   109.47
_symmetry_Int_Tables_number   1
_chemical_formula_structural   B5W24
_chemical_formula_sum   'B5 W24'
_cell_volume   476.05
_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
  B  B0  1  0.54  0.46  0.54  1.0
  B  B1  1  0.46  0.54  0.54  1.0
  B  B2  1  0.54  0.54  0.46  1.0
  B  B3  1  0.38  0.38  0.38  1.0
  B  B4  1  0.0  0.0  0.0  1.0
  W  W5  1  0.93  0.07  0.86  1.0
  W  W6  1  0.07  0.93  0.86  1.0
  W  W7  1  0.93  0.93  0.98  1.0
  W  W8  1  0.99  0.99  0.06  1.0
  W  W9  1  0.93  0.98  0.93  1.0
  W  W10  1  0.99  0.06  0.99  1.0
  W  W11  1  0.07  0.86  0.93  1.0
  W  W12  1  0.93  0.86  0.07  1.0
  W  W13  1  0.86  0.07  0.93  1.0
  W  W14  1  0.86  0.93  0.07  1.0
  W  W15  1  0.06  0.99  0.99  1.0
  W  W16  1  0.98  0.93  0.93  1.0
  W  W17  1  0.66  0.34  0.51  1.0
  W  W18  1  0.34  0.66  0.51  1.0
  W  W19  1  0.58  0.58  0.41  1.0
  W  W20  1  0.34  0.34  0.33  1.0
  W  W21  1  0.58  0.41  0.58  1.0
  W  W22  1  0.34  0.33  0.34  1.0
  W  W23  1  0.34  0.51  0.66  1.0
  W  W24  1  0.66  0.51  0.34  1.0
  W  W25  1  0.51  0.34  0.66  1.0
  W  W26  1  0.51  0.66  0.34  1.0
  W  W27  1  0.33  0.34  0.34  1.0
  W  W28  1  0.41  0.58  0.58  1.0

data_B5W24
_symmetry_space_group_name_H-M   R3m
_cell_length_a   13.91
_cell_length_b   13.91
_cell_length_c   8.52
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   B5W24
_chemical_formula_sum   'B15 W72'
_cell_volume   1428.15
_cell_formula_units_Z   3
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-y, x-y, z'
  3  '-x+y, -x, z'
  4  '-y, -x, z'
  5  '-x+y, y, z'
  6  'x, x-y, z'
  7  'x+2/3, y+1/3, z+1/3'
  8  '-y+2/3, x-y+1/3, z+1/3'
  9  '-x+y+2/3, -x+1/3, z+1/3'
  10  '-y+2/3, -x+1/3, z+1/3'
  11  '-x+y+2/3, y+1/3, z+1/3'
  12  'x+2/3, x-y+1/3, z+1/3'
  13  'x+1/3, y+2/3, z+2/3'
  14  '-y+1/3, x-y+2/3, z+2/3'
  15  '-x+y+1/3, -x+2/3, z+2/3'
  16  '-y+1/3, -x+2/3, z+2/3'
  17  '-x+y+1/3, y+2/3, z+2/3'
  18  'x+1/3, x-y+2/3, z+2/3'
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
  B  B0  9  0.02  0.05  0.51  1.0
  B  B1  3  0.0  0.0  0.0  1.0
  B  B2  3  0.0  0.0  0.38  1.0
  W  W3  18  0.0  0.16  0.5  1.0
  W  W4  18  0.12  0.02  0.95  1.0
  W  W5  9  0.0  0.01  0.34  1.0
  W  W6  9  0.03  0.02  0.95  1.0
  W  W7  9  0.05  0.02  0.01  1.0
  W  W8  9  0.05  0.11  0.52  1.0

B B B B B W W W W W W W W W W W W W W W W W W W W W W W W