# generated using pymatgen
data_LiEr2S2O8F3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.40610700
_cell_length_b   8.17286400
_cell_length_c   14.80236900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiEr2S2O8F3
_chemical_formula_sum   'Li4 Er8 S8 O32 F12'
_cell_volume   774.99640289
_cell_formula_units_Z   4
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
  Li  Li0  1  0.63044600  0.75000000  0.00000000  1
  Li  Li1  1  0.13044600  0.75000000  0.50000000  1
  Li  Li2  1  0.36955400  0.25000000  0.00000000  1
  Li  Li3  1  0.86955400  0.25000000  0.50000000  1
  Er  Er4  1  0.60814800  0.63408500  0.60149300  1
  Er  Er5  1  0.89185200  0.13408500  0.89850700  1
  Er  Er6  1  0.60814800  0.86591500  0.39850700  1
  Er  Er7  1  0.39185200  0.13408500  0.60149300  1
  Er  Er8  1  0.89185200  0.36591500  0.10149300  1
  Er  Er9  1  0.10814800  0.86591500  0.10149300  1
  Er  Er10  1  0.39185200  0.36591500  0.39850700  1
  Er  Er11  1  0.10814800  0.63408500  0.89850700  1
  S  S12  1  0.39302400  0.50525600  0.16450200  1
  S  S13  1  0.60697600  0.00525600  0.16450200  1
  S  S14  1  0.89302400  0.50525600  0.33549800  1
  S  S15  1  0.10697600  0.49474400  0.66450200  1
  S  S16  1  0.10697600  0.00525600  0.33549800  1
  S  S17  1  0.89302400  0.99474400  0.66450200  1
  S  S18  1  0.60697600  0.49474400  0.83549800  1
  S  S19  1  0.39302400  0.99474400  0.83549800  1
  O  O20  1  0.43578300  0.06548400  0.74568000  1
  O  O21  1  0.59341800  0.97547400  0.88573400  1
  O  O22  1  0.40658200  0.47547400  0.88573400  1
  O  O23  1  0.24206900  0.60883400  0.61033200  1
  O  O24  1  0.43578300  0.43451600  0.25432000  1
  O  O25  1  0.56421700  0.56548400  0.74568000  1
  O  O26  1  0.06421700  0.56548400  0.75432000  1
  O  O27  1  0.06421700  0.93451600  0.24568000  1
  O  O28  1  0.75793100  0.10883400  0.61033200  1
  O  O29  1  0.21077200  0.16482200  0.32380900  1
  O  O30  1  0.93578300  0.43451600  0.24568000  1
  O  O31  1  0.90658200  0.47547400  0.61426600  1
  O  O32  1  0.71077200  0.16482200  0.17619100  1
  O  O33  1  0.71077200  0.33517800  0.82380900  1
  O  O34  1  0.40658200  0.02452600  0.11426600  1
  O  O35  1  0.74206900  0.89116600  0.11033200  1
  O  O36  1  0.28922800  0.83517800  0.82380900  1
  O  O37  1  0.28922800  0.66482200  0.17619100  1
  O  O38  1  0.93578300  0.06548400  0.75432000  1
  O  O39  1  0.56421700  0.93451600  0.25432000  1
  O  O40  1  0.25793100  0.10883400  0.88966800  1
  O  O41  1  0.78922800  0.66482200  0.32380900  1
  O  O42  1  0.21077200  0.33517800  0.67619100  1
  O  O43  1  0.24206900  0.89116600  0.38966800  1
  O  O44  1  0.25793100  0.39116600  0.11033200  1
  O  O45  1  0.59341800  0.52452600  0.11426600  1
  O  O46  1  0.09341800  0.97547400  0.61426600  1
  O  O47  1  0.74206900  0.60883400  0.88966800  1
  O  O48  1  0.90658200  0.02452600  0.38573400  1
  O  O49  1  0.78922800  0.83517800  0.67619100  1
  O  O50  1  0.09341800  0.52452600  0.38573400  1
  O  O51  1  0.75793100  0.39116600  0.38966800  1
  F  F52  1  0.03633000  0.37511300  0.94887100  1
  F  F53  1  0.96367000  0.87511300  0.94887100  1
  F  F54  1  0.96367000  0.62488700  0.05112900  1
  F  F55  1  0.67642400  0.25000000  0.00000000  1
  F  F56  1  0.03633000  0.12488700  0.05112900  1
  F  F57  1  0.53633000  0.37511300  0.55112900  1
  F  F58  1  0.32357600  0.75000000  0.00000000  1
  F  F59  1  0.53633000  0.12488700  0.44887100  1
  F  F60  1  0.82357600  0.75000000  0.50000000  1
  F  F61  1  0.46367000  0.87511300  0.55112900  1
  F  F62  1  0.17642400  0.25000000  0.50000000  1
  F  F63  1  0.46367000  0.62488700  0.44887100  1
