# generated using pymatgen
data_MgNb5(B2Ru5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.35880914
_cell_length_b   9.35880914
_cell_length_c   3.02684560
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgNb5(B2Ru5)2
_chemical_formula_sum   'Mg1 Nb5 B4 Ru10'
_cell_volume   265.11325993
_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
  Mg  Mg0  1  0.50000000  0.50000000  0.00000000  1.0
  Nb  Nb1  1  0.81928366  0.67408862  0.00000000  1.0
  Nb  Nb2  1  0.18071634  0.32591138  0.00000000  1.0
  Nb  Nb3  1  0.32591138  0.81928366  0.00000000  1.0
  Nb  Nb4  1  0.67408862  0.18071634  0.00000000  1.0
  Nb  Nb5  1  0.00000000  0.00000000  0.00000000  1.0
  B  B6  1  0.61706346  0.87169967  0.00000000  1.0
  B  B7  1  0.38293654  0.12830033  0.00000000  1.0
  B  B8  1  0.12830033  0.61706346  0.00000000  1.0
  B  B9  1  0.87169967  0.38293654  0.00000000  1.0
  Ru  Ru10  1  0.50000000  0.00000000  0.50000000  1.0
  Ru  Ru11  1  0.00000000  0.50000000  0.50000000  1.0
  Ru  Ru12  1  0.57360158  0.71825648  0.50000000  1.0
  Ru  Ru13  1  0.42639842  0.28174352  0.50000000  1.0
  Ru  Ru14  1  0.06936211  0.78076791  0.50000000  1.0
  Ru  Ru15  1  0.93063789  0.21923209  0.50000000  1.0
  Ru  Ru16  1  0.28174352  0.57360158  0.50000000  1.0
  Ru  Ru17  1  0.71825648  0.42639842  0.50000000  1.0
  Ru  Ru18  1  0.21923209  0.06936211  0.50000000  1.0
  Ru  Ru19  1  0.78076791  0.93063789  0.50000000  1.0