# generated using pymatgen
data_ErZr3(ScRu2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.47561289
_cell_length_b   4.57898779
_cell_length_c   9.16441598
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00146460
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ErZr3(ScRu2)4
_chemical_formula_sum   'Er1 Zr3 Sc4 Ru8'
_cell_volume   271.74099307
_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
  Er  Er0  1  0.74995999  0.25000000  0.12499683  1.0
  Zr  Zr1  1  0.24993201  0.75000000  0.37536484  1.0
  Zr  Zr2  1  0.75003226  0.25000000  0.62500030  1.0
  Zr  Zr3  1  0.25006580  0.75000000  0.87463384  1.0
  Sc  Sc4  1  0.24996192  0.25000000  0.12499577  1.0
  Sc  Sc5  1  0.74992045  0.75000000  0.37603299  1.0
  Sc  Sc6  1  0.25004211  0.25000000  0.62500262  1.0
  Sc  Sc7  1  0.75007796  0.75000000  0.87396880  1.0
  Ru  Ru8  1  0.49258777  0.75000000  0.12499674  1.0
  Ru  Ru9  1  0.00736396  0.75000000  0.12499218  1.0
  Ru  Ru10  1  0.49654092  0.25000000  0.37983336  1.0
  Ru  Ru11  1  0.00336322  0.25000000  0.37983316  1.0
  Ru  Ru12  1  0.99970204  0.75000000  0.62500376  1.0
  Ru  Ru13  1  0.50034944  0.75000000  0.62500354  1.0
  Ru  Ru14  1  0.00345465  0.25000000  0.87017270  1.0
  Ru  Ru15  1  0.49664349  0.25000000  0.87016857  1.0