# generated using pymatgen
data_La5(BN3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.69610099
_cell_length_b   6.54042294
_cell_length_c   9.05178765
_cell_angle_alpha   104.94349204
_cell_angle_beta   90.00000000
_cell_angle_gamma   106.41294884
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La5(BN3)2
_chemical_formula_sum   'La5 B2 N6'
_cell_volume   202.17523892
_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
  La  La0  1  0.37514955  0.75029910  0.62533169  1.0
  La  La1  1  0.69186222  0.38372544  0.81862697  1.0
  La  La2  1  0.00000000  0.00000000  -0.00000000  1.0
  La  La3  1  0.30813778  0.61627456  0.18137303  1.0
  La  La4  1  0.62485045  0.24970090  0.37466831  1.0
  B  B5  1  0.94558653  0.89117205  0.41106939  1.0
  B  B6  1  0.05441347  0.10882795  0.58893061  1.0
  N  N7  1  0.97474293  0.94948685  0.26358452  1.0
  N  N8  1  0.65627137  0.31254273  0.07745958  1.0
  N  N9  1  0.17103984  0.34208069  0.58311244  1.0
  N  N10  1  0.02525707  0.05051315  0.73641548  1.0
  N  N11  1  0.34372863  0.68745727  0.92254042  1.0
  N  N12  1  0.82896016  0.65791931  0.41688756  1.0