# generated using pymatgen
data_TmNb2B2Ru5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.49353675
_cell_length_b   9.49353774
_cell_length_c   3.07105851
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.59043128
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TmNb2B2Ru5
_chemical_formula_sum   'Tm2 Nb4 B4 Ru10'
_cell_volume   276.77898525
_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
  Tm  Tm0  1  0.17548670  0.17548670  0.00000000  1.0
  Tm  Tm1  1  0.82451330  0.82451330  0.00000000  1.0
  Nb  Nb2  1  0.50000000  0.00000000  0.00000000  1.0
  Nb  Nb3  1  0.00000000  0.50000000  0.00000000  1.0
  Nb  Nb4  1  0.67582033  0.32417967  0.00000000  1.0
  Nb  Nb5  1  0.32417967  0.67582033  0.00000000  1.0
  B  B6  1  0.37889151  0.37889151  0.00000000  1.0
  B  B7  1  0.62110849  0.62110849  0.00000000  1.0
  B  B8  1  0.87985485  0.12014515  0.00000000  1.0
  B  B9  1  0.12014515  0.87985485  0.00000000  1.0
  Ru  Ru10  1  0.50000000  0.50000000  0.50000000  1.0
  Ru  Ru11  1  0.00000000  0.00000000  0.50000000  1.0
  Ru  Ru12  1  0.43801404  0.22231336  0.50000000  1.0
  Ru  Ru13  1  0.56198596  0.77768664  0.50000000  1.0
  Ru  Ru14  1  0.91956955  0.28494658  0.50000000  1.0
  Ru  Ru15  1  0.08043045  0.71505342  0.50000000  1.0
  Ru  Ru16  1  0.71505342  0.08043045  0.50000000  1.0
  Ru  Ru17  1  0.28494658  0.91956955  0.50000000  1.0
  Ru  Ru18  1  0.77768664  0.56198596  0.50000000  1.0
  Ru  Ru19  1  0.22231336  0.43801404  0.50000000  1.0