# generated using pymatgen
data_Y(MnS2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.52172643
_cell_length_b   7.68858496
_cell_length_c   10.53405532
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y(MnS2)2
_chemical_formula_sum   'Y4 Mn8 S16'
_cell_volume   609.19951133
_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
  Y  Y0  1  0.50000000  0.00000000  0.00000000  1
  Y  Y1  1  0.00000000  0.00000000  0.50000000  1
  Y  Y2  1  0.00000000  0.50000000  0.50000000  1
  Y  Y3  1  0.50000000  0.50000000  0.00000000  1
  Mn  Mn4  1  0.00000000  0.25000000  0.12963900  1
  Mn  Mn5  1  0.50000000  0.25000000  0.37036100  1
  Mn  Mn6  1  0.75000000  0.25000000  0.75000000  1
  Mn  Mn7  1  0.25000000  0.25000000  0.75000000  1
  Mn  Mn8  1  0.50000000  0.75000000  0.62963900  1
  Mn  Mn9  1  0.00000000  0.75000000  0.87036100  1
  Mn  Mn10  1  0.25000000  0.75000000  0.25000000  1
  Mn  Mn11  1  0.75000000  0.75000000  0.25000000  1
  S  S12  1  0.50000000  0.52610300  0.25754500  1
  S  S13  1  0.50000000  0.97389700  0.25754500  1
  S  S14  1  0.25143500  0.25000000  0.51397700  1
  S  S15  1  0.00000000  0.97389700  0.24245500  1
  S  S16  1  0.75143500  0.25000000  0.98602300  1
  S  S17  1  0.00000000  0.52610300  0.24245500  1
  S  S18  1  0.74856500  0.25000000  0.51397700  1
  S  S19  1  0.24856500  0.25000000  0.98602300  1
  S  S20  1  0.00000000  0.02610300  0.75754500  1
  S  S21  1  0.00000000  0.47389700  0.75754500  1
  S  S22  1  0.75143500  0.75000000  0.01397700  1
  S  S23  1  0.50000000  0.47389700  0.74245500  1
  S  S24  1  0.25143500  0.75000000  0.48602300  1
  S  S25  1  0.50000000  0.02610300  0.74245500  1
  S  S26  1  0.24856500  0.75000000  0.01397700  1
  S  S27  1  0.74856500  0.75000000  0.48602300  1
