# generated using pymatgen
data_Er9ScZn3Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.22176659
_cell_length_b   9.22176608
_cell_length_c   9.44986277
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999831
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er9ScZn3Ru
_chemical_formula_sum   'Er18 Sc2 Zn6 Ru2'
_cell_volume   695.96014175
_cell_formula_units_Z   2
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  0.20690563  0.79309437  0.44147602  1.0
  Er  Er1  1  0.20690563  0.41381026  0.44147602  1.0
  Er  Er2  1  0.58618974  0.79309437  0.44147602  1.0
  Er  Er3  1  0.79309437  0.20690563  0.55852398  1.0
  Er  Er4  1  0.79309437  0.58618974  0.55852398  1.0
  Er  Er5  1  0.41381026  0.20690563  0.55852398  1.0
  Er  Er6  1  0.79309437  0.20690563  0.94147602  1.0
  Er  Er7  1  0.79309437  0.58618974  0.94147602  1.0
  Er  Er8  1  0.41381026  0.20690563  0.94147602  1.0
  Er  Er9  1  0.20690563  0.79309437  0.05852398  1.0
  Er  Er10  1  0.20690563  0.41381026  0.05852398  1.0
  Er  Er11  1  0.58618974  0.79309437  0.05852398  1.0
  Er  Er12  1  0.54190131  0.45809869  0.25000000  1.0
  Er  Er13  1  0.54190131  0.08380161  0.25000000  1.0
  Er  Er14  1  0.91619839  0.45809869  0.25000000  1.0
  Er  Er15  1  0.45809869  0.54190131  0.75000000  1.0
  Er  Er16  1  0.45809869  0.91619839  0.75000000  1.0
  Er  Er17  1  0.08380161  0.54190131  0.75000000  1.0
  Sc  Sc18  1  0.00000000  0.00000000  0.50000000  1.0
  Sc  Sc19  1  0.00000000  0.00000000  0.00000000  1.0
  Zn  Zn20  1  0.89260137  0.10739863  0.25000000  1.0
  Zn  Zn21  1  0.89260137  0.78520473  0.25000000  1.0
  Zn  Zn22  1  0.21479527  0.10739863  0.25000000  1.0
  Zn  Zn23  1  0.10739863  0.89260137  0.75000000  1.0
  Zn  Zn24  1  0.10739863  0.21479527  0.75000000  1.0
  Zn  Zn25  1  0.78520473  0.89260137  0.75000000  1.0
  Ru  Ru26  1  0.33333300  0.66666700  0.25000000  1.0
  Ru  Ru27  1  0.66666700  0.33333300  0.75000000  1.0