# generated using pymatgen
data_La10Sn6PBr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.62668859
_cell_length_b   9.62668147
_cell_length_c   7.20980874
_cell_angle_alpha   89.99930215
_cell_angle_beta   90.00028949
_cell_angle_gamma   120.00005525
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La10Sn6PBr
_chemical_formula_sum   'La10 Sn6 P1 Br1'
_cell_volume   578.63894390
_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
  La  La0  1  0.25129517  0.25129265  0.76703173  1.0
  La  La1  1  0.99999971  0.74871626  0.76697443  1.0
  La  La2  1  0.74870541  0.99999731  0.76700806  1.0
  La  La3  1  0.00000029  0.25128374  0.23302557  1.0
  La  La4  1  0.33333470  0.66666676  0.50000069  1.0
  La  La5  1  0.74870483  0.74870735  0.23296827  1.0
  La  La6  1  0.66666530  0.33333324  0.49999931  1.0
  La  La7  1  0.25129459  0.00000269  0.23299194  1.0
  La  La8  1  0.33333111  0.66666414  0.99999894  1.0
  La  La9  1  0.66666889  0.33333586  0.00000106  1.0
  Sn  Sn10  1  0.60611268  0.99999883  0.24932114  1.0
  Sn  Sn11  1  0.00000170  0.39388923  0.75067811  1.0
  Sn  Sn12  1  0.39388732  0.00000117  0.75067886  1.0
  Sn  Sn13  1  0.60611059  0.60610939  0.75068344  1.0
  Sn  Sn14  1  0.99999830  0.60611077  0.24932189  1.0
  Sn  Sn15  1  0.39388941  0.39389061  0.24931656  1.0
  P  P16  1  0.00000000  0.00000000  0.00000000  1.0
  Br  Br17  1  0.00000000  0.00000000  0.50000000  1.0