# generated using pymatgen
data_LaScB6Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.66152338
_cell_length_b   9.11567848
_cell_length_c   11.58750535
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaScB6Ru
_chemical_formula_sum   'La4 Sc4 B24 Ru4'
_cell_volume   386.75929349
_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  0.32382886  0.41573089  1.0
  La  La1  1  0.00000000  0.67617114  0.58426911  1.0
  La  La2  1  0.00000000  0.82382886  0.08426911  1.0
  La  La3  1  0.00000000  0.17617114  0.91573089  1.0
  Sc  Sc4  1  0.00000000  0.94729282  0.37423594  1.0
  Sc  Sc5  1  0.00000000  0.05270718  0.62576406  1.0
  Sc  Sc6  1  0.00000000  0.44729282  0.12576406  1.0
  Sc  Sc7  1  0.00000000  0.55270718  0.87423594  1.0
  B  B8  1  0.50000000  0.56138342  0.42477446  1.0
  B  B9  1  0.50000000  0.43861658  0.57522554  1.0
  B  B10  1  0.50000000  0.06138342  0.07522554  1.0
  B  B11  1  0.50000000  0.93861658  0.92477446  1.0
  B  B12  1  0.50000000  0.75546318  0.41424880  1.0
  B  B13  1  0.50000000  0.24453682  0.58575120  1.0
  B  B14  1  0.50000000  0.25546318  0.08575120  1.0
  B  B15  1  0.50000000  0.74453682  0.91424880  1.0
  B  B16  1  0.50000000  0.79460697  0.26574727  1.0
  B  B17  1  0.50000000  0.20539303  0.73425273  1.0
  B  B18  1  0.50000000  0.29460697  0.23425273  1.0
  B  B19  1  0.50000000  0.70539303  0.76574727  1.0
  B  B20  1  0.50000000  0.62993850  0.18267164  1.0
  B  B21  1  0.50000000  0.37006150  0.81732836  1.0
  B  B22  1  0.50000000  0.12993850  0.31732836  1.0
  B  B23  1  0.50000000  0.87006150  0.68267164  1.0
  B  B24  1  0.50000000  0.98715562  0.21717773  1.0
  B  B25  1  0.50000000  0.01284438  0.78282227  1.0
  B  B26  1  0.50000000  0.48715562  0.28282227  1.0
  B  B27  1  0.50000000  0.51284438  0.71717773  1.0
  B  B28  1  0.50000000  0.59752679  0.02528193  1.0
  B  B29  1  0.50000000  0.40247321  0.97471807  1.0
  B  B30  1  0.50000000  0.09752679  0.47471807  1.0
  B  B31  1  0.50000000  0.90247321  0.52528193  1.0
  Ru  Ru32  1  0.00000000  0.64398312  0.31518721  1.0
  Ru  Ru33  1  0.00000000  0.35601688  0.68481279  1.0
  Ru  Ru34  1  0.00000000  0.14398312  0.18481279  1.0
  Ru  Ru35  1  0.00000000  0.85601688  0.81518721  1.0