# generated using pymatgen
data_Sm2Tc2I
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.13224789
_cell_length_b   4.13224745
_cell_length_c   18.09832807
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99997978
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm2Tc2I
_chemical_formula_sum   'Sm4 Tc4 I2'
_cell_volume   267.63435656
_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
  Sm  Sm0  1  0.00000000  0.00000000  0.11387747  1.0
  Sm  Sm1  1  0.00000000  0.00000000  0.61387747  1.0
  Sm  Sm2  1  0.00000000  0.00000000  0.38612253  1.0
  Sm  Sm3  1  0.00000000  0.00000000  0.88612253  1.0
  Tc  Tc4  1  0.66666700  0.33333300  0.98726660  1.0
  Tc  Tc5  1  0.33333300  0.66666700  0.01273340  1.0
  Tc  Tc6  1  0.66666700  0.33333300  0.51273340  1.0
  Tc  Tc7  1  0.33333300  0.66666700  0.48726660  1.0
  I  I8  1  0.66666700  0.33333300  0.25000000  1.0
  I  I9  1  0.33333300  0.66666700  0.75000000  1.0