# generated using pymatgen
data_Y10Sn6SCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.04723527
_cell_length_b   9.04723520
_cell_length_c   6.64794497
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999306
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y10Sn6SCl
_chemical_formula_sum   'Y10 Sn6 S1 Cl1'
_cell_volume   471.24835024
_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
  Y  Y0  1  0.66666700  0.33333300  0.00000000  1.0
  Y  Y1  1  0.33333300  0.66666700  0.00000000  1.0
  Y  Y2  1  0.33333300  0.66666700  0.50000000  1.0
  Y  Y3  1  0.66666700  0.33333300  0.50000000  1.0
  Y  Y4  1  0.74737611  0.74737611  0.74035833  1.0
  Y  Y5  1  0.25262389  0.00000000  0.74035833  1.0
  Y  Y6  1  0.00000000  0.25262389  0.74035833  1.0
  Y  Y7  1  0.25262389  0.25262389  0.25964167  1.0
  Y  Y8  1  0.74737611  1.00000000  0.25964167  1.0
  Y  Y9  1  1.00000000  0.74737611  0.25964167  1.0
  Sn  Sn10  1  0.39402239  0.39402239  0.75052304  1.0
  Sn  Sn11  1  0.60597761  1.00000000  0.75052304  1.0
  Sn  Sn12  1  1.00000000  0.60597761  0.75052304  1.0
  Sn  Sn13  1  0.60597761  0.60597761  0.24947696  1.0
  Sn  Sn14  1  0.39402239  0.00000000  0.24947696  1.0
  Sn  Sn15  1  0.00000000  0.39402239  0.24947696  1.0
  S  S16  1  0.00000000  0.00000000  0.50000000  1.0
  Cl  Cl17  1  0.00000000  0.00000000  0.00000000  1.0