# generated using pymatgen
data_PmSbSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.19336365
_cell_length_b   4.19336365
_cell_length_c   9.10200720
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PmSbSe
_chemical_formula_sum   'Pm2 Sb2 Se2'
_cell_volume   160.05241348
_cell_formula_units_Z   2
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
  Pm  Pm0  1  0.00000000  0.50000000  0.70413843  1.0
  Pm  Pm1  1  0.50000000  0.00000000  0.29586157  1.0
  Sb  Sb2  1  0.00000000  0.00000000  0.00000000  1.0
  Sb  Sb3  1  0.50000000  0.50000000  0.00000000  1.0
  Se  Se4  1  0.00000000  0.50000000  0.37357969  1.0
  Se  Se5  1  0.50000000  0.00000000  0.62642031  1.0