# generated using pymatgen
data_Sc3Ga2BRu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.97623903
_cell_length_b   6.97623867
_cell_length_c   3.21177975
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999705
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc3Ga2BRu3
_chemical_formula_sum   'Sc3 Ga2 B1 Ru3'
_cell_volume   135.36895702
_cell_formula_units_Z   1
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  0.36524344  0.36524344  0.50000000  1.0
  Sc  Sc1  1  0.63475656  0.00000000  0.50000000  1.0
  Sc  Sc2  1  0.00000000  0.63475656  0.50000000  1.0
  Ga  Ga3  1  0.66666700  0.33333300  0.00000000  1.0
  Ga  Ga4  1  0.33333300  0.66666700  0.00000000  1.0
  B  B5  1  0.00000000  0.00000000  0.50000000  1.0
  Ru  Ru6  1  0.00000000  0.23837275  0.00000000  1.0
  Ru  Ru7  1  0.23837275  0.00000000  0.00000000  1.0
  Ru  Ru8  1  0.76162725  0.76162725  0.00000000  1.0