# generated using pymatgen
data_LaScReB6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.68427139
_cell_length_b   9.12813336
_cell_length_c   11.65861748
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaScReB6
_chemical_formula_sum   'La4 Sc4 Re4 B24'
_cell_volume   392.08537554
_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
  La  La0  1  0.00000000  0.32271307  0.41607151  1.0
  La  La1  1  0.00000000  0.67728693  0.58392849  1.0
  La  La2  1  0.00000000  0.82271307  0.08392849  1.0
  La  La3  1  0.00000000  0.17728693  0.91607151  1.0
  Sc  Sc4  1  0.00000000  0.94353611  0.36674347  1.0
  Sc  Sc5  1  0.00000000  0.05646389  0.63325653  1.0
  Sc  Sc6  1  0.00000000  0.44353611  0.13325653  1.0
  Sc  Sc7  1  0.00000000  0.55646389  0.86674347  1.0
  Re  Re8  1  0.00000000  0.64265279  0.31524170  1.0
  Re  Re9  1  0.00000000  0.35734721  0.68475830  1.0
  Re  Re10  1  0.00000000  0.14265279  0.18475830  1.0
  Re  Re11  1  0.00000000  0.85734721  0.81524170  1.0
  B  B12  1  0.50000000  0.55927233  0.42603484  1.0
  B  B13  1  0.50000000  0.44072767  0.57396516  1.0
  B  B14  1  0.50000000  0.05927233  0.07396516  1.0
  B  B15  1  0.50000000  0.94072767  0.92603484  1.0
  B  B16  1  0.50000000  0.75556722  0.41286692  1.0
  B  B17  1  0.50000000  0.24443278  0.58713308  1.0
  B  B18  1  0.50000000  0.25556722  0.08713308  1.0
  B  B19  1  0.50000000  0.74443278  0.91286692  1.0
  B  B20  1  0.50000000  0.79475984  0.26468542  1.0
  B  B21  1  0.50000000  0.20524016  0.73531458  1.0
  B  B22  1  0.50000000  0.29475984  0.23531458  1.0
  B  B23  1  0.50000000  0.70524016  0.76468542  1.0
  B  B24  1  0.50000000  0.62829669  0.18385211  1.0
  B  B25  1  0.50000000  0.37170331  0.81614789  1.0
  B  B26  1  0.50000000  0.12829669  0.31614789  1.0
  B  B27  1  0.50000000  0.87170331  0.68385211  1.0
  B  B28  1  0.50000000  0.98479932  0.21565774  1.0
  B  B29  1  0.50000000  0.01520068  0.78434226  1.0
  B  B30  1  0.50000000  0.48479932  0.28434226  1.0
  B  B31  1  0.50000000  0.51520068  0.71565774  1.0
  B  B32  1  0.50000000  0.59168493  0.02395013  1.0
  B  B33  1  0.50000000  0.40831507  0.97604987  1.0
  B  B34  1  0.50000000  0.09168493  0.47604987  1.0
  B  B35  1  0.50000000  0.90831507  0.52395013  1.0