# generated using pymatgen
data_TaNbP7Ru12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.34311331
_cell_length_b   9.34311205
_cell_length_c   3.79093326
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000005
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaNbP7Ru12
_chemical_formula_sum   'Ta1 Nb1 P7 Ru12'
_cell_volume   286.58928105
_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  0.66666700  0.33333300  0.50000000  1.0
  Nb  Nb1  1  0.33333300  0.66666700  0.00000000  1.0
  P  P2  1  0.59331907  0.71251913  0.50000000  1.0
  P  P3  1  0.00000000  0.00000000  0.00000000  1.0
  P  P4  1  0.28748087  0.88080194  0.50000000  1.0
  P  P5  1  0.11919806  0.40668093  0.50000000  1.0
  P  P6  1  0.88426284  0.58926897  0.00000000  1.0
  P  P7  1  0.41073103  0.29499487  0.00000000  1.0
  P  P8  1  0.70500513  0.11573716  0.00000000  1.0
  Ru  Ru9  1  0.54853653  0.93335220  0.50000000  1.0
  Ru  Ru10  1  0.38481767  0.45146347  0.50000000  1.0
  Ru  Ru11  1  0.89300785  0.13788442  0.50000000  1.0
  Ru  Ru12  1  0.24487757  0.10699215  0.50000000  1.0
  Ru  Ru13  1  0.86211558  0.75512243  0.50000000  1.0
  Ru  Ru14  1  0.72665458  0.87946304  0.00000000  1.0
  Ru  Ru15  1  0.12053696  0.84719154  0.00000000  1.0
  Ru  Ru16  1  0.15280846  0.27334542  0.00000000  1.0
  Ru  Ru17  1  0.44954288  0.07822997  0.00000000  1.0
  Ru  Ru18  1  0.92177003  0.37131391  0.00000000  1.0
  Ru  Ru19  1  0.62868609  0.55045712  0.00000000  1.0
  Ru  Ru20  1  0.06664780  0.61518233  0.50000000  1.0