# generated using pymatgen
data_Mg5P12Ir4Ru15
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.34063332
_cell_length_b   12.34063359
_cell_length_c   3.92204141
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000452
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg5P12Ir4Ru15
_chemical_formula_sum   'Mg5 P12 Ir4 Ru15'
_cell_volume   517.27047809
_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  0.33333300  0.66666700  0.00000000  1.0
  Mg  Mg1  1  0.66666700  0.33333300  0.00000000  1.0
  Mg  Mg2  1  0.82275364  0.00183241  0.50000000  1.0
  Mg  Mg3  1  0.99816759  0.82092023  0.50000000  1.0
  Mg  Mg4  1  0.17907977  0.17724636  0.50000000  1.0
  P  P5  1  0.17956530  0.99544649  0.00000000  1.0
  P  P6  1  0.00455351  0.18411882  0.00000000  1.0
  P  P7  1  0.81588118  0.82043470  0.00000000  1.0
  P  P8  1  0.16964624  0.47613187  0.50000000  1.0
  P  P9  1  0.52386813  0.69351437  0.50000000  1.0
  P  P10  1  0.30648563  0.83035376  0.50000000  1.0
  P  P11  1  0.68984674  0.52212171  0.50000000  1.0
  P  P12  1  0.83227398  0.31015326  0.50000000  1.0
  P  P13  1  0.47787829  0.16772602  0.50000000  1.0
  P  P14  1  0.62281121  0.99577150  0.00000000  1.0
  P  P15  1  0.00422850  0.62703971  0.00000000  1.0
  P  P16  1  0.37296029  0.37718879  0.00000000  1.0
  Ir  Ir17  1  0.81683040  0.62868907  0.00000000  1.0
  Ir  Ir18  1  0.81185866  0.18316960  0.00000000  1.0
  Ir  Ir19  1  0.37131093  0.18814134  0.00000000  1.0
  Ir  Ir20  1  0.00000000  0.00000000  0.00000000  1.0
  Ru  Ru21  1  0.44654979  0.00577364  0.00000000  1.0
  Ru  Ru22  1  0.99422636  0.44077616  0.00000000  1.0
  Ru  Ru23  1  0.55922384  0.55345021  0.00000000  1.0
  Ru  Ru24  1  0.36690190  0.49401380  0.50000000  1.0
  Ru  Ru25  1  0.50598620  0.87288810  0.50000000  1.0
  Ru  Ru26  1  0.12711190  0.63309810  0.50000000  1.0
  Ru  Ru27  1  0.86786197  0.50550991  0.50000000  1.0
  Ru  Ru28  1  0.63764694  0.13213803  0.50000000  1.0
  Ru  Ru29  1  0.49449009  0.36235306  0.50000000  1.0
  Ru  Ru30  1  0.18619332  0.37840448  0.00000000  1.0
  Ru  Ru31  1  0.62159552  0.80778983  0.00000000  1.0
  Ru  Ru32  1  0.19221017  0.81380668  0.00000000  1.0
  Ru  Ru33  1  0.27729498  0.00140335  0.50000000  1.0
  Ru  Ru34  1  0.99859665  0.27589163  0.50000000  1.0
  Ru  Ru35  1  0.72410837  0.72270502  0.50000000  1.0