data_YVB4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.01
_cell_length_b   11.64
_cell_length_c   3.45
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YVB4
_chemical_formula_sum   'Y4 V4 B16'
_cell_volume   241.51
_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  0.75  0.06  0.73  1.0
  Y  Y1  1  0.26  0.58  0.73  1.0
  Y  Y2  1  0.75  0.76  0.73  1.0
  Y  Y3  1  0.26  0.88  0.73  1.0
  V  V4  1  0.77  0.96  0.73  1.0
  V  V5  1  0.24  0.68  0.73  1.0
  V  V6  1  0.76  0.86  0.73  1.0
  V  V7  1  0.25  0.78  0.73  1.0
  B  B8  1  0.72  0.16  0.0  1.0
  B  B9  1  0.28  0.48  0.0  1.0
  B  B10  1  0.72  0.66  0.0  1.0
  B  B11  1  0.29  0.98  0.0  1.0
  B  B12  1  0.19  0.38  0.0  1.0
  B  B13  1  0.82  0.26  0.0  1.0
  B  B14  1  0.19  0.44  0.0  1.0
  B  B15  1  0.82  0.2  0.0  1.0
  B  B16  1  0.32  0.27  0.0  1.0
  B  B17  1  0.69  0.37  0.0  1.0
  B  B18  1  0.32  0.55  0.0  1.0
  B  B19  1  0.69  0.09  0.0  1.0
  B  B20  1  0.87  0.58  0.0  1.0
  B  B21  1  0.13  0.06  0.0  1.0
  B  B22  1  0.87  0.24  0.0  1.0
  B  B23  1  0.14  0.4  0.0  1.0

data_YVB4
_symmetry_space_group_name_H-M   P2
_cell_length_a   6.01
_cell_length_b   3.45
_cell_length_c   11.64
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   3
_chemical_formula_structural   YVB4
_chemical_formula_sum   'Y4 V4 B16'
_cell_volume   241.51
_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  0.25  0.27  0.26  1.0
  Y  Y1  2  0.26  0.27  0.56  1.0
  V  V2  2  0.24  0.27  0.36  1.0
  V  V3  2  0.24  0.27  0.46  1.0
  B  B4  2  0.13  0.0  0.74  1.0
  B  B5  2  0.13  -0.0  0.08  1.0
  B  B6  2  0.18  -0.0  0.12  1.0
  B  B7  2  0.19  -0.0  0.06  1.0
  B  B8  2  0.28  -0.0  0.16  1.0
  B  B9  2  0.28  -0.0  0.66  1.0
  B  B10  2  0.31  0.0  0.23  1.0
  B  B11  2  0.32  -0.0  0.95  1.0

Y Y Y Y V V V V B B B B B B B B B B B B B B B B