# generated using pymatgen
data_YScVB6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.47369150
_cell_length_b   9.08476758
_cell_length_c   11.42495549
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YScVB6
_chemical_formula_sum   'Y4 Sc4 V4 B24'
_cell_volume   360.54508825
_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  0.00000000  0.82304078  0.08497202  1.0
  Y  Y1  1  0.00000000  0.17695922  0.91502798  1.0
  Y  Y2  1  0.00000000  0.32304078  0.41502798  1.0
  Y  Y3  1  0.00000000  0.67695922  0.58497202  1.0
  Sc  Sc4  1  0.00000000  0.44312910  0.13164053  1.0
  Sc  Sc5  1  0.00000000  0.55687090  0.86835947  1.0
  Sc  Sc6  1  0.00000000  0.94312910  0.36835947  1.0
  Sc  Sc7  1  0.00000000  0.05687090  0.63164053  1.0
  V  V8  1  0.00000000  0.14273698  0.18222961  1.0
  V  V9  1  0.00000000  0.85726302  0.81777039  1.0
  V  V10  1  0.00000000  0.64273698  0.31777039  1.0
  V  V11  1  0.00000000  0.35726302  0.68222961  1.0
  B  B12  1  0.50000000  0.05458736  0.06706974  1.0
  B  B13  1  0.50000000  0.94541264  0.93293026  1.0
  B  B14  1  0.50000000  0.55458736  0.43293026  1.0
  B  B15  1  0.50000000  0.44541264  0.56706974  1.0
  B  B16  1  0.50000000  0.25492353  0.08204293  1.0
  B  B17  1  0.50000000  0.74507647  0.91795707  1.0
  B  B18  1  0.50000000  0.75492353  0.41795707  1.0
  B  B19  1  0.50000000  0.24507647  0.58204293  1.0
  B  B20  1  0.50000000  0.29612742  0.23672669  1.0
  B  B21  1  0.50000000  0.70387258  0.76327331  1.0
  B  B22  1  0.50000000  0.79612742  0.26327331  1.0
  B  B23  1  0.50000000  0.20387258  0.73672669  1.0
  B  B24  1  0.50000000  0.12981109  0.31820341  1.0
  B  B25  1  0.50000000  0.87018891  0.68179659  1.0
  B  B26  1  0.50000000  0.62981109  0.18179659  1.0
  B  B27  1  0.50000000  0.37018891  0.81820341  1.0
  B  B28  1  0.50000000  0.48170799  0.28617574  1.0
  B  B29  1  0.50000000  0.51829201  0.71382426  1.0
  B  B30  1  0.50000000  0.98170799  0.21382426  1.0
  B  B31  1  0.50000000  0.01829201  0.78617574  1.0
  B  B32  1  0.50000000  0.09472635  0.47444562  1.0
  B  B33  1  0.50000000  0.90527365  0.52555438  1.0
  B  B34  1  0.50000000  0.59472635  0.02555438  1.0
  B  B35  1  0.50000000  0.40527365  0.97444562  1.0