# generated using pymatgen
data_ErZr5(SnRu2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.56541065
_cell_length_b   6.45416246
_cell_length_c   13.69864956
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000538
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ErZr5(SnRu2)6
_chemical_formula_sum   'Er1 Zr5 Sn6 Ru12'
_cell_volume   403.64306575
_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  0.00000000  0.50000000  0.00000000  1.0
  Zr  Zr1  1  0.49999635  0.00000000  0.16693137  1.0
  Zr  Zr2  1  0.99999794  0.50000000  0.33325761  1.0
  Zr  Zr3  1  0.50000100  0.00000000  0.50000000  1.0
  Zr  Zr4  1  0.00000206  0.50000000  0.66674239  1.0
  Zr  Zr5  1  0.50000365  0.00000000  0.83306863  1.0
  Sn  Sn6  1  0.00000000  0.00000000  0.00000000  1.0
  Sn  Sn7  1  0.49999382  0.50000000  0.16631355  1.0
  Sn  Sn8  1  0.99999789  0.00000000  0.33417273  1.0
  Sn  Sn9  1  0.50000100  0.50000000  0.50000000  1.0
  Sn  Sn10  1  0.00000211  0.00000000  0.66582727  1.0
  Sn  Sn11  1  0.50000618  0.50000000  0.83368745  1.0
  Ru  Ru12  1  0.50000000  0.24212060  0.00000000  1.0
  Ru  Ru13  1  0.50000000  0.75787840  0.00000000  1.0
  Ru  Ru14  1  0.99999429  0.24672687  0.17027990  1.0
  Ru  Ru15  1  0.99999429  0.75327413  0.17027990  1.0
  Ru  Ru16  1  0.49999806  0.25046506  0.33436169  1.0
  Ru  Ru17  1  0.49999806  0.74953594  0.33436169  1.0
  Ru  Ru18  1  0.00000000  0.25000362  0.50000000  1.0
  Ru  Ru19  1  0.00000000  0.74999738  0.50000000  1.0
  Ru  Ru20  1  0.50000194  0.25046506  0.66563831  1.0
  Ru  Ru21  1  0.50000194  0.74953594  0.66563831  1.0
  Ru  Ru22  1  0.00000571  0.24672687  0.82972010  1.0
  Ru  Ru23  1  0.00000571  0.75327413  0.82972010  1.0