# generated using pymatgen
data_TiNb2(GaRu2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.34511502
_cell_length_b   6.14161551
_cell_length_c   13.01785669
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00008496
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiNb2(GaRu2)3
_chemical_formula_sum   'Ti2 Nb4 Ga6 Ru12'
_cell_volume   347.39485979
_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
  Ti  Ti0  1  0.00014825  0.00000000  0.66903579  1.0
  Ti  Ti1  1  0.50014573  0.50000100  0.83096748  1.0
  Nb  Nb2  1  0.00000700  0.00000000  0.99607101  1.0
  Nb  Nb3  1  0.49987719  0.50000100  0.16524245  1.0
  Nb  Nb4  1  0.99987377  0.00000000  0.33475628  1.0
  Nb  Nb5  1  0.50000243  0.50000100  0.50393111  1.0
  Ga  Ga6  1  0.99999526  0.50000100  0.99647501  1.0
  Ga  Ga7  1  0.49978909  0.00000000  0.16510780  1.0
  Ga  Ga8  1  0.99978966  0.50000100  0.33488030  1.0
  Ga  Ga9  1  0.49999667  0.00000000  0.50353211  1.0
  Ga  Ga10  1  0.00016421  0.50000100  0.66841714  1.0
  Ga  Ga11  1  0.50013771  0.00000000  0.83158812  1.0
  Ru  Ru12  1  0.50000515  0.25155861  0.99838728  1.0
  Ru  Ru13  1  0.50000515  0.74844139  0.99838728  1.0
  Ru  Ru14  1  0.99985732  0.25037905  0.16639158  1.0
  Ru  Ru15  1  0.99985732  0.74962095  0.16639158  1.0
  Ru  Ru16  1  0.49985769  0.24961945  0.33360194  1.0
  Ru  Ru17  1  0.49985769  0.75038055  0.33360194  1.0
  Ru  Ru18  1  0.00000732  0.24844597  0.50160844  1.0
  Ru  Ru19  1  0.00000732  0.75155403  0.50160844  1.0
  Ru  Ru20  1  0.50015666  0.24873745  0.66808109  1.0
  Ru  Ru21  1  0.50015666  0.75126255  0.66808109  1.0
  Ru  Ru22  1  0.00014788  0.25126504  0.83192688  1.0
  Ru  Ru23  1  0.00014788  0.74873496  0.83192688  1.0