# generated using pymatgen
data_Er2PS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.77356981
_cell_length_b   6.77356975
_cell_length_c   6.77356988
_cell_angle_alpha   131.95313601
_cell_angle_beta   131.95313258
_cell_angle_gamma   70.30305231
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er2PS
_chemical_formula_sum   'Er4 P2 S2'
_cell_volume   168.45926074
_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  0.49534061  0.99534061  0.50000000  1.0
  Er  Er1  1  0.00465939  0.50465939  0.50000000  1.0
  Er  Er2  1  0.74534061  0.74534061  0.00000000  1.0
  Er  Er3  1  0.25465939  0.25465939  1.00000000  1.0
  P  P4  1  0.25000000  0.75000000  0.50000000  1.0
  P  P5  1  0.50000000  0.50000000  0.00000000  1.0
  S  S6  1  0.00000000  0.00000000  0.00000000  1.0
  S  S7  1  0.75000000  0.25000000  0.50000000  1.0