# generated using pymatgen
data_Er(CrFe5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.68090700
_cell_length_b   6.37819103
_cell_length_c   6.37819103
_cell_angle_alpha   97.40587617
_cell_angle_beta   111.52741437
_cell_angle_gamma   68.47258563
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er(CrFe5)2
_chemical_formula_sum   'Er1 Cr2 Fe10'
_cell_volume   164.78111783
_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  0.00000000  0.00000000  1.0
  Cr  Cr1  1  0.00000000  0.36688800  0.36688800  1.0
  Cr  Cr2  1  0.00000000  0.63311200  0.63311200  1.0
  Fe  Fe3  1  0.72517000  0.77483000  0.22517000  1.0
  Fe  Fe4  1  0.27483000  0.22517000  0.77483000  1.0
  Fe  Fe5  1  0.50000000  0.77328100  0.77328100  1.0
  Fe  Fe6  1  0.50000000  0.22671900  0.22671900  1.0
  Fe  Fe7  1  0.50000000  0.00000000  0.50000000  1.0
  Fe  Fe8  1  0.00000000  0.00000000  0.50000000  1.0
  Fe  Fe9  1  0.50000000  0.50000000  0.00000000  1.0
  Fe  Fe10  1  0.00000000  0.50000000  0.00000000  1.0
  Fe  Fe11  1  0.64090400  0.35909600  0.64090400  1.0
  Fe  Fe12  1  0.35909600  0.64090400  0.35909600  1.0