# generated using pymatgen
data_LuNb5(B2Ru5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.44999314
_cell_length_b   9.44999314
_cell_length_c   3.04498478
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.15459196
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuNb5(B2Ru5)2
_chemical_formula_sum   'Lu1 Nb5 B4 Ru10'
_cell_volume   271.92336839
_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
  Lu  Lu0  1  0.82449923  0.67550077  0.00000000  1.0
  Nb  Nb1  1  0.17683012  0.32316988  0.00000000  1.0
  Nb  Nb2  1  0.32428705  0.82269079  0.00000000  1.0
  Nb  Nb3  1  0.67730921  0.17571295  0.00000000  1.0
  Nb  Nb4  1  0.50173755  0.50075877  0.00000000  1.0
  Nb  Nb5  1  0.99924123  0.99826245  0.00000000  1.0
  B  B6  1  0.61986351  0.88013649  0.00000000  1.0
  B  B7  1  0.37725613  0.12274387  0.00000000  1.0
  B  B8  1  0.12225832  0.61993236  0.00000000  1.0
  B  B9  1  0.88006764  0.37774168  0.00000000  1.0
  Ru  Ru10  1  0.56079884  0.72384016  0.50000000  1.0
  Ru  Ru11  1  0.42683331  0.28262255  0.50000000  1.0
  Ru  Ru12  1  0.07933055  0.78168208  0.50000000  1.0
  Ru  Ru13  1  0.93053247  0.21675984  0.50000000  1.0
  Ru  Ru14  1  0.28324016  0.56946753  0.50000000  1.0
  Ru  Ru15  1  0.71831792  0.42066945  0.50000000  1.0
  Ru  Ru16  1  0.21737745  0.07316669  0.50000000  1.0
  Ru  Ru17  1  0.77615984  0.93920116  0.50000000  1.0
  Ru  Ru18  1  0.49664879  0.00335121  0.50000000  1.0
  Ru  Ru19  1  0.00741167  0.49258833  0.50000000  1.0