# generated using pymatgen
data_Er4In5S13
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.84725800
_cell_length_b   11.84737000
_cell_length_c   21.49718600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er4In5S13
_chemical_formula_sum   'Er8 In10 S26'
_cell_volume   979.83935194
_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  0.00000000  0.67195200  0.34025800  1.0
  Er  Er1  1  0.00000000  0.32804800  0.65974200  1.0
  Er  Er2  1  0.00000000  0.82804800  0.84025800  1.0
  Er  Er3  1  0.00000000  0.17195200  0.15974200  1.0
  Er  Er4  1  0.00000000  0.51467300  0.17194600  1.0
  Er  Er5  1  0.00000000  0.48532700  0.82805400  1.0
  Er  Er6  1  0.00000000  0.98532700  0.67194600  1.0
  Er  Er7  1  0.00000000  0.01467300  0.32805400  1.0
  In  In8  1  0.00000000  0.50000000  0.50000000  1.0
  In  In9  1  0.00000000  0.00000000  0.00000000  1.0
  In  In10  1  0.50000000  0.84501500  0.49310700  1.0
  In  In11  1  0.50000000  0.15498500  0.50689300  1.0
  In  In12  1  0.50000000  0.65498500  0.99310700  1.0
  In  In13  1  0.50000000  0.34501500  0.00689300  1.0
  In  In14  1  0.50000000  0.84419400  0.17106600  1.0
  In  In15  1  0.50000000  0.15580600  0.82893400  1.0
  In  In16  1  0.50000000  0.65580600  0.67106600  1.0
  In  In17  1  0.50000000  0.34419400  0.32893400  1.0
  S  S18  1  0.50000000  0.84836300  0.36523900  1.0
  S  S19  1  0.50000000  0.15163700  0.63476100  1.0
  S  S20  1  0.50000000  0.65163700  0.86523900  1.0
  S  S21  1  0.50000000  0.34836300  0.13476100  1.0
  S  S22  1  0.50000000  0.57952500  0.26103500  1.0
  S  S23  1  0.50000000  0.42047500  0.73896500  1.0
  S  S24  1  0.50000000  0.92047500  0.76103500  1.0
  S  S25  1  0.50000000  0.07952500  0.23896500  1.0
  S  S26  1  0.50000000  0.50653400  0.40462500  1.0
  S  S27  1  0.50000000  0.49346600  0.59537500  1.0
  S  S28  1  0.50000000  0.99346600  0.90462500  1.0
  S  S29  1  0.50000000  0.00653400  0.09537500  1.0
  S  S30  1  0.00000000  0.70310700  0.47244000  1.0
  S  S31  1  0.00000000  0.29689300  0.52756000  1.0
  S  S32  1  0.00000000  0.79689300  0.97244000  1.0
  S  S33  1  0.00000000  0.20310700  0.02756000  1.0
  S  S34  1  0.00000000  0.83236100  0.24374900  1.0
  S  S35  1  0.00000000  0.16763900  0.75625100  1.0
  S  S36  1  0.00000000  0.66763900  0.74374900  1.0
  S  S37  1  0.00000000  0.33236100  0.25625100  1.0
  S  S38  1  0.50000000  0.65463800  0.11596200  1.0
  S  S39  1  0.50000000  0.34536200  0.88403800  1.0
  S  S40  1  0.50000000  0.84536200  0.61596200  1.0
  S  S41  1  0.50000000  0.15463800  0.38403800  1.0
  S  S42  1  0.00000000  0.00000000  0.50000000  1.0
  S  S43  1  0.00000000  0.50000000  0.00000000  1.0