# generated using pymatgen
data_CrB2Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.91172600
_cell_length_b   4.31419800
_cell_length_c   5.85197300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrB2Ru
_chemical_formula_sum   'Cr2 B4 Ru2'
_cell_volume   73.51109490
_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
  Cr  Cr0  1  0.00000000  0.12782600  0.68315900  1.0
  Cr  Cr1  1  0.00000000  0.87217400  0.18315900  1.0
  B  B2  1  0.00000000  0.65074100  0.52912200  1.0
  B  B3  1  0.00000000  0.34925900  0.02912200  1.0
  B  B4  1  0.50000000  0.86727400  0.46596500  1.0
  B  B5  1  0.50000000  0.13272600  0.96596500  1.0
  Ru  Ru6  1  0.50000000  0.36328300  0.32175400  1.0
  Ru  Ru7  1  0.50000000  0.63671700  0.82175400  1.0