# generated using pymatgen
data_Sm2BC
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.73132123
_cell_length_b   6.73132220
_cell_length_c   9.45256942
_cell_angle_alpha   50.75264197
_cell_angle_beta   50.75263635
_cell_angle_gamma   31.12848777
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm2BC
_chemical_formula_sum   'Sm4 B2 C2'
_cell_volume   166.97025571
_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  0.20549782  0.20549782  0.88383872  1.0
  Sm  Sm1  1  0.79450218  0.79450218  0.11616128  1.0
  Sm  Sm2  1  0.55994669  0.55994669  0.63995914  1.0
  Sm  Sm3  1  0.44005331  0.44005331  0.36004086  1.0
  B  B4  1  0.92341439  0.92341439  0.60826243  1.0
  B  B5  1  0.07658561  0.07658561  0.39173757  1.0
  C  C6  1  0.12676959  0.12676959  0.19672529  1.0
  C  C7  1  0.87323041  0.87323041  0.80327471  1.0