# generated using pymatgen
data_Mg2P7(IrRu5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.26854521
_cell_length_b   9.38629472
_cell_length_c   3.90571717
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.33787737
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg2P7(IrRu5)2
_chemical_formula_sum   'Mg2 P7 Ir2 Ru10'
_cell_volume   293.25704759
_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
  Mg  Mg0  1  0.66742458  0.33528524  0.50000000  1.0
  Mg  Mg1  1  0.33410472  0.66692129  0.00000000  1.0
  P  P2  1  0.59932943  0.71944975  0.50000000  1.0
  P  P3  1  0.00071526  0.00020113  0.00000000  1.0
  P  P4  1  0.27387764  0.87520591  0.50000000  1.0
  P  P5  1  0.11406939  0.40141465  0.50000000  1.0
  P  P6  1  0.88317796  0.57374925  0.00000000  1.0
  P  P7  1  0.42977073  0.30542834  0.00000000  1.0
  P  P8  1  0.69815806  0.12104792  0.00000000  1.0
  Ir  Ir9  1  0.54568604  0.93916972  0.50000000  1.0
  Ir  Ir10  1  0.39035879  0.45227763  0.50000000  1.0
  Ru  Ru11  1  0.91860937  0.12276975  0.50000000  1.0
  Ru  Ru12  1  0.21041657  0.08411995  0.50000000  1.0
  Ru  Ru13  1  0.87619556  0.79728182  0.50000000  1.0
  Ru  Ru14  1  0.72467820  0.89189318  0.00000000  1.0
  Ru  Ru15  1  0.10945026  0.83672170  0.00000000  1.0
  Ru  Ru16  1  0.16788721  0.27151116  0.00000000  1.0
  Ru  Ru17  1  0.43400984  0.06998405  0.00000000  1.0
  Ru  Ru18  1  0.93701230  0.36063487  0.00000000  1.0
  Ru  Ru19  1  0.63910799  0.57083519  0.00000000  1.0
  Ru  Ru20  1  0.04596010  0.60409650  0.50000000  1.0