# generated using pymatgen
data_Tm2SO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.71391194
_cell_length_b   3.71391266
_cell_length_c   6.49250428
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000250
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm2SO2
_chemical_formula_sum   'Tm2 S1 O2'
_cell_volume   77.55434845
_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
  Tm  Tm0  1  0.33333300  0.66666700  0.28399525  1.0
  Tm  Tm1  1  0.66666700  0.33333300  0.71600475  1.0
  S  S2  1  0.00000000  0.00000000  0.00000000  1.0
  O  O3  1  0.33333300  0.66666700  0.62909342  1.0
  O  O4  1  0.66666700  0.33333300  0.37090658  1.0