# generated using pymatgen
data_MgSc5(TaRu2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.47202545
_cell_length_b   6.31448428
_cell_length_c   13.42588305
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.99993840
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgSc5(TaRu2)6
_chemical_formula_sum   'Mg1 Sc5 Ta6 Ru12'
_cell_volume   379.12726004
_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  0.50003421  0.49999900  0.83330585  1.0
  Sc  Sc1  1  0.99999186  0.00000000  0.99925457  1.0
  Sc  Sc2  1  0.49994092  0.49999900  0.16498318  1.0
  Sc  Sc3  1  0.99995073  0.00000000  0.33336966  1.0
  Sc  Sc4  1  0.50000637  0.49999900  0.50171781  1.0
  Sc  Sc5  1  0.00005362  0.00000000  0.66737328  1.0
  Ta  Ta6  1  0.99998845  0.49999900  0.99447516  1.0
  Ta  Ta7  1  0.49995059  0.00000000  0.16564130  1.0
  Ta  Ta8  1  0.99996001  0.49999900  0.33335865  1.0
  Ta  Ta9  1  0.50000447  0.00000000  0.50105375  1.0
  Ta  Ta10  1  0.00005913  0.49999900  0.67215797  1.0
  Ta  Ta11  1  0.50004015  0.00000000  0.83330770  1.0
  Ru  Ru12  1  0.49999153  0.24960402  0.00020157  1.0
  Ru  Ru13  1  0.49999153  0.75039498  0.00020157  1.0
  Ru  Ru14  1  0.99994637  0.25038145  0.16652683  1.0
  Ru  Ru15  1  0.99994637  0.74961755  0.16652683  1.0
  Ru  Ru16  1  0.49995191  0.25072811  0.33337478  1.0
  Ru  Ru17  1  0.49995191  0.74927189  0.33337478  1.0
  Ru  Ru18  1  0.00000426  0.25038250  0.50018232  1.0
  Ru  Ru19  1  0.00000426  0.74961750  0.50018232  1.0
  Ru  Ru20  1  0.50005710  0.24960576  0.66642282  1.0
  Ru  Ru21  1  0.50005710  0.75039424  0.66642282  1.0
  Ru  Ru22  1  0.00005257  0.24893824  0.83329125  1.0
  Ru  Ru23  1  0.00005257  0.75106076  0.83329125  1.0