# generated using pymatgen
data_Lu2P7(IrRu5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.31421718
_cell_length_b   9.37968580
_cell_length_c   3.91385830
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.14471123
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu2P7(IrRu5)2
_chemical_formula_sum   'Lu2 P7 Ir2 Ru10'
_cell_volume   295.68904916
_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
  Lu  Lu0  1  0.66777632  0.33335716  0.50000000  1.0
  Lu  Lu1  1  0.33060943  0.66556917  0.00000000  1.0
  P  P2  1  0.59964186  0.71684120  0.50000000  1.0
  P  P3  1  0.00005802  0.00062083  0.00000000  1.0
  P  P4  1  0.27790544  0.87824402  0.50000000  1.0
  P  P5  1  0.11435456  0.40327377  0.50000000  1.0
  P  P6  1  0.88396840  0.57554734  0.00000000  1.0
  P  P7  1  0.42574455  0.30299482  0.00000000  1.0
  P  P8  1  0.69804103  0.12047869  0.00000000  1.0
  Ir  Ir9  1  0.54962714  0.94027475  0.50000000  1.0
  Ir  Ir10  1  0.38967058  0.44885731  0.50000000  1.0
  Ru  Ru11  1  0.91457574  0.12604397  0.50000000  1.0
  Ru  Ru12  1  0.21605553  0.08854277  0.50000000  1.0
  Ru  Ru13  1  0.87387400  0.79011994  0.50000000  1.0
  Ru  Ru14  1  0.72598557  0.89135753  0.00000000  1.0
  Ru  Ru15  1  0.10947876  0.83821324  0.00000000  1.0
  Ru  Ru16  1  0.16628054  0.27202697  0.00000000  1.0
  Ru  Ru17  1  0.43262376  0.06740385  0.00000000  1.0
  Ru  Ru18  1  0.93495196  0.36226124  0.00000000  1.0
  Ru  Ru19  1  0.63753703  0.56891951  0.00000000  1.0
  Ru  Ru20  1  0.05123979  0.60905091  0.50000000  1.0