# generated using pymatgen
data_ZrTa5(B2Ru5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.40923701
_cell_length_b   9.40923701
_cell_length_c   3.02984829
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.08712742
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrTa5(B2Ru5)2
_chemical_formula_sum   'Zr1 Ta5 B4 Ru10'
_cell_volume   268.24349423
_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
  Zr  Zr0  1  0.82462726  0.67537274  0.00000000  1.0
  Ta  Ta1  1  0.17657715  0.32342285  0.00000000  1.0
  Ta  Ta2  1  0.32448789  0.82364656  0.00000000  1.0
  Ta  Ta3  1  0.67635344  0.17551211  0.00000000  1.0
  Ta  Ta4  1  0.50022268  0.50019232  0.00000000  1.0
  Ta  Ta5  1  0.99980768  0.99977732  0.00000000  1.0
  B  B6  1  0.62026054  0.87973946  0.00000000  1.0
  B  B7  1  0.37789385  0.12210615  0.00000000  1.0
  B  B8  1  0.12205972  0.62098070  0.00000000  1.0
  B  B9  1  0.87901930  0.37794028  0.00000000  1.0
  Ru  Ru10  1  0.56604537  0.72069785  0.50000000  1.0
  Ru  Ru11  1  0.42760552  0.28244691  0.50000000  1.0
  Ru  Ru12  1  0.07599654  0.78238692  0.50000000  1.0
  Ru  Ru13  1  0.92923043  0.21702868  0.50000000  1.0
  Ru  Ru14  1  0.28297132  0.57076957  0.50000000  1.0
  Ru  Ru15  1  0.71761308  0.42400346  0.50000000  1.0
  Ru  Ru16  1  0.21755309  0.07239448  0.50000000  1.0
  Ru  Ru17  1  0.77930215  0.93395463  0.50000000  1.0
  Ru  Ru18  1  0.49829686  0.00170314  0.50000000  1.0
  Ru  Ru19  1  0.00407512  0.49592488  0.50000000  1.0