# generated using pymatgen
data_SmTh2(BN2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.45392584
_cell_length_b   6.45392644
_cell_length_c   6.45392683
_cell_angle_alpha   148.07376420
_cell_angle_beta   121.80468114
_cell_angle_gamma   67.92902366
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmTh2(BN2)2
_chemical_formula_sum   'Sm1 Th2 B2 N4'
_cell_volume   119.27611201
_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
  Sm  Sm0  1  0.30410139  0.80410139  0.50000000  1.0
  Th  Th1  1  0.70006985  0.20006985  0.50000000  1.0
  Th  Th2  1  0.00102507  0.00102507  1.00000000  1.0
  B  B3  1  0.35943711  0.49846782  0.86096929  1.0
  B  B4  1  0.63749853  0.49846782  0.13903071  1.0
  N  N5  1  0.35867546  0.61965391  0.73902155  1.0
  N  N6  1  0.88063136  0.61965391  0.26097845  1.0
  N  N7  1  0.11728821  0.37928112  0.73800610  1.0
  N  N8  1  0.64127502  0.37928112  0.26199390  1.0