# generated using pymatgen
data_Zr2Tc2B4Ru3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.07119229
_cell_length_b   8.59043403
_cell_length_c   9.96143544
_cell_angle_alpha   90.00066197
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Tc2B4Ru3
_chemical_formula_sum   'Zr4 Tc4 B8 Ru6'
_cell_volume   262.81130362
_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
  Zr  Zr0  1  0.50000000  0.83896473  0.18163401  1.0
  Zr  Zr1  1  0.50000000  0.16103527  0.81836599  1.0
  Zr  Zr2  1  0.50000000  0.66105093  0.68169241  1.0
  Zr  Zr3  1  0.50000000  0.33894907  0.31830759  1.0
  Tc  Tc4  1  0.00000000  0.66087560  0.95282490  1.0
  Tc  Tc5  1  0.00000000  0.33912440  0.04717510  1.0
  Tc  Tc6  1  0.00000000  0.83915080  0.45282040  1.0
  Tc  Tc7  1  0.00000000  0.16084920  0.54717960  1.0
  B  B8  1  0.50000000  0.96631644  0.58721615  1.0
  B  B9  1  0.50000000  0.03368356  0.41278385  1.0
  B  B10  1  0.50000000  0.84912370  0.90100563  1.0
  B  B11  1  0.50000000  0.15087630  0.09899437  1.0
  B  B12  1  0.50000000  0.65087917  0.40100884  1.0
  B  B13  1  0.50000000  0.34912083  0.59899116  1.0
  B  B14  1  0.50000000  0.46631575  0.91278701  1.0
  B  B15  1  0.50000000  0.53368425  0.08721299  1.0
  Ru  Ru16  1  0.00000000  0.00000000  0.00000000  1.0
  Ru  Ru17  1  0.00000000  0.40804978  0.76056872  1.0
  Ru  Ru18  1  0.00000000  0.59195022  0.23943128  1.0
  Ru  Ru19  1  0.00000000  0.50000000  0.50000000  1.0
  Ru  Ru20  1  0.00000000  0.90802505  0.73949974  1.0
  Ru  Ru21  1  0.00000000  0.09197495  0.26050026  1.0