# generated using pymatgen
data_Tm3P2S
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.76467008
_cell_length_b   6.76467009
_cell_length_c   6.76467048
_cell_angle_alpha   146.45301747
_cell_angle_beta   131.87670520
_cell_angle_gamma   59.93627878
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm3P2S
_chemical_formula_sum   'Tm3 P2 S1'
_cell_volume   126.21492238
_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  0.50000000  0.00000000  0.50000000  1.0
  Tm  Tm1  1  0.17121529  0.67121529  0.50000000  1.0
  Tm  Tm2  1  0.82878471  0.32878471  0.50000000  1.0
  P  P3  1  0.66555031  0.66555031  0.00000000  1.0
  P  P4  1  0.33444969  0.33444969  1.00000000  1.0
  S  S5  1  0.00000000  0.00000000  0.00000000  1.0