# generated using pymatgen
data_ScTa2B2Ru5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.40011695
_cell_length_b   9.40011695
_cell_length_c   3.04935202
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.96835760
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScTa2B2Ru5
_chemical_formula_sum   'Sc2 Ta4 B4 Ru10'
_cell_volume   269.44740831
_cell_formula_units_Z   2
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
  Sc  Sc0  1  0.82536804  0.67463196  0.00000000  1.0
  Sc  Sc1  1  0.17463196  0.32536804  0.00000000  1.0
  Ta  Ta2  1  0.32376658  0.82376658  0.00000000  1.0
  Ta  Ta3  1  0.67623342  0.17623342  0.00000000  1.0
  Ta  Ta4  1  0.50000000  0.50000000  0.00000000  1.0
  Ta  Ta5  1  0.00000000  0.00000000  0.00000000  1.0
  B  B6  1  0.62264772  0.87735228  0.00000000  1.0
  B  B7  1  0.37735228  0.12264772  0.00000000  1.0
  B  B8  1  0.11937142  0.61937142  0.00000000  1.0
  B  B9  1  0.88062858  0.38062858  0.00000000  1.0
  Ru  Ru10  1  0.56446791  0.72036637  0.50000000  1.0
  Ru  Ru11  1  0.43553209  0.27963363  0.50000000  1.0
  Ru  Ru12  1  0.07814437  0.78462576  0.50000000  1.0
  Ru  Ru13  1  0.92185563  0.21537424  0.50000000  1.0
  Ru  Ru14  1  0.28462576  0.57814437  0.50000000  1.0
  Ru  Ru15  1  0.71537424  0.42185563  0.50000000  1.0
  Ru  Ru16  1  0.22036637  0.06446791  0.50000000  1.0
  Ru  Ru17  1  0.77963363  0.93553209  0.50000000  1.0
  Ru  Ru18  1  0.50000000  0.00000000  0.50000000  1.0
  Ru  Ru19  1  0.00000000  0.50000000  0.50000000  1.0