# generated using pymatgen
data_CeEr2S3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.87665073
_cell_length_b   3.87665138
_cell_length_c   9.80144642
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998600
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CeEr2S3
_chemical_formula_sum   'Ce1 Er2 S3'
_cell_volume   127.56580851
_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
  Ce  Ce0  1  0.00000000  0.00000000  0.00000000  1.0
  Er  Er1  1  0.33333300  0.66666700  0.66384572  1.0
  Er  Er2  1  0.66666700  0.33333300  0.33615428  1.0
  S  S3  1  0.33333300  0.66666700  0.18389752  1.0
  S  S4  1  0.66666700  0.33333300  0.81610248  1.0
  S  S5  1  0.00000000  0.00000000  0.50000000  1.0