# generated using pymatgen
data_TaMn5(NbRu2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.40417461
_cell_length_b   6.25240128
_cell_length_c   13.20890212
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.99976800
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaMn5(NbRu2)6
_chemical_formula_sum   'Ta1 Mn5 Nb6 Ru12'
_cell_volume   363.72913875
_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
  Ta  Ta0  1  0.00000000  0.50000000  0.00000000  1.0
  Mn  Mn1  1  0.49999122  0.00000000  0.16763410  1.0
  Mn  Mn2  1  0.99999016  0.50000000  0.33489145  1.0
  Mn  Mn3  1  0.50000000  0.00000000  0.50000000  1.0
  Mn  Mn4  1  0.00000984  0.50000000  0.66510855  1.0
  Mn  Mn5  1  0.50000878  0.00000000  0.83236590  1.0
  Nb  Nb6  1  0.00000000  0.00000000  0.00000000  1.0
  Nb  Nb7  1  0.49999530  0.50000000  0.17566776  1.0
  Nb  Nb8  1  0.99998775  0.00000000  0.33520438  1.0
  Nb  Nb9  1  0.50000000  0.50000000  0.50000000  1.0
  Nb  Nb10  1  0.00001225  0.00000000  0.66479562  1.0
  Nb  Nb11  1  0.50000470  0.50000000  0.82433224  1.0
  Ru  Ru12  1  0.50000000  0.25524162  0.00000000  1.0
  Ru  Ru13  1  0.50000000  0.74475738  0.00000000  1.0
  Ru  Ru14  1  0.99999170  0.25288269  0.16376026  1.0
  Ru  Ru15  1  0.99999170  0.74711731  0.16376026  1.0
  Ru  Ru16  1  0.49999252  0.24806367  0.33376975  1.0
  Ru  Ru17  1  0.49999252  0.75193633  0.33376975  1.0
  Ru  Ru18  1  0.00000000  0.24873734  0.50000000  1.0
  Ru  Ru19  1  0.00000000  0.75126266  0.50000000  1.0
  Ru  Ru20  1  0.50000948  0.24806367  0.66623025  1.0
  Ru  Ru21  1  0.50000948  0.75193633  0.66623025  1.0
  Ru  Ru22  1  0.00000830  0.25288269  0.83624074  1.0
  Ru  Ru23  1  0.00000830  0.74711731  0.83624074  1.0