# generated using pymatgen
data_Nb5Cr(B2Ru5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.98508500
_cell_length_b   9.44186600
_cell_length_c   9.44186600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb5Cr(B2Ru5)2
_chemical_formula_sum   'Nb5 Cr1 B4 Ru10'
_cell_volume   266.11684583
_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
  Nb  Nb0  1  0.00000000  0.67478400  0.82104200  1.0
  Nb  Nb1  1  0.00000000  0.32521600  0.17895800  1.0
  Nb  Nb2  1  0.00000000  0.82104200  0.32521600  1.0
  Nb  Nb3  1  0.00000000  0.17895800  0.67478400  1.0
  Nb  Nb4  1  0.00000000  0.00000000  0.00000000  1.0
  Cr  Cr5  1  0.00000000  0.50000000  0.50000000  1.0
  B  B6  1  0.00000000  0.87498700  0.61971200  1.0
  B  B7  1  0.00000000  0.12501300  0.38028800  1.0
  B  B8  1  0.00000000  0.61971200  0.12501300  1.0
  B  B9  1  0.00000000  0.38028800  0.87498700  1.0
  Ru  Ru10  1  0.50000000  0.71349500  0.56841600  1.0
  Ru  Ru11  1  0.50000000  0.28650500  0.43158400  1.0
  Ru  Ru12  1  0.50000000  0.77988300  0.07204800  1.0
  Ru  Ru13  1  0.50000000  0.22011700  0.92795200  1.0
  Ru  Ru14  1  0.50000000  0.56841600  0.28650500  1.0
  Ru  Ru15  1  0.50000000  0.43158400  0.71349500  1.0
  Ru  Ru16  1  0.50000000  0.07204800  0.22011700  1.0
  Ru  Ru17  1  0.50000000  0.92795200  0.77988300  1.0
  Ru  Ru18  1  0.50000000  0.00000000  0.50000000  1.0
  Ru  Ru19  1  0.50000000  0.50000000  0.00000000  1.0