# generated using pymatgen
data_La9B3C6I5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.97998200
_cell_length_b   8.30836800
_cell_length_c   33.86252300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La9B3C6I5
_chemical_formula_sum   'La18 B6 C12 I10'
_cell_volume   1119.73729976
_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
  La  La0  1  0.50000000  0.92284400  0.84520900  1.0
  La  La1  1  0.50000000  0.18446700  0.75907600  1.0
  La  La2  1  0.00000000  0.81553300  0.74092400  1.0
  La  La3  1  0.00000000  0.43522200  0.00000000  1.0
  La  La4  1  0.00000000  0.07715600  0.34520900  1.0
  La  La5  1  0.00000000  0.66301000  0.61559300  1.0
  La  La6  1  0.50000000  0.94572500  0.44373500  1.0
  La  La7  1  0.00000000  0.05427500  0.05626500  1.0
  La  La8  1  0.50000000  0.33699000  0.88440700  1.0
  La  La9  1  0.50000000  0.94572500  0.55626500  1.0
  La  La10  1  0.00000000  0.05427500  0.94373500  1.0
  La  La11  1  0.00000000  0.66301000  0.38440700  1.0
  La  La12  1  0.00000000  0.07715600  0.65479100  1.0
  La  La13  1  0.00000000  0.81553300  0.25907600  1.0
  La  La14  1  0.50000000  0.56477800  0.50000000  1.0
  La  La15  1  0.50000000  0.33699000  0.11559300  1.0
  La  La16  1  0.50000000  0.18446700  0.24092400  1.0
  La  La17  1  0.50000000  0.92284400  0.15479100  1.0
  B  B18  1  0.00000000  0.77765400  0.50000000  1.0
  B  B19  1  0.50000000  0.86971500  0.67026100  1.0
  B  B20  1  0.50000000  0.22234600  0.00000000  1.0
  B  B21  1  0.00000000  0.13028500  0.17026100  1.0
  B  B22  1  0.00000000  0.13028500  0.82973900  1.0
  B  B23  1  0.50000000  0.86971500  0.32973900  1.0
  C  C24  1  0.50000000  0.86661000  0.37373200  1.0
  C  C25  1  0.50000000  0.97023700  0.70669500  1.0
  C  C26  1  0.00000000  0.02976300  0.20669500  1.0
  C  C27  1  0.50000000  0.26376500  0.04286400  1.0
  C  C28  1  0.00000000  0.73623500  0.54286400  1.0
  C  C29  1  0.00000000  0.02976300  0.79330500  1.0
  C  C30  1  0.50000000  0.26376500  0.95713600  1.0
  C  C31  1  0.50000000  0.97023700  0.29330500  1.0
  C  C32  1  0.00000000  0.13339000  0.87373200  1.0
  C  C33  1  0.50000000  0.86661000  0.62626800  1.0
  C  C34  1  0.00000000  0.13339000  0.12626800  1.0
  C  C35  1  0.00000000  0.73623500  0.45713600  1.0
  I  I36  1  0.00000000  0.42977800  0.70133900  1.0
  I  I37  1  0.50000000  0.33004900  0.40294300  1.0
  I  I38  1  0.00000000  0.66995100  0.90294300  1.0
  I  I39  1  0.00000000  0.66995100  0.09705700  1.0
  I  I40  1  0.50000000  0.57022200  0.20133900  1.0
  I  I41  1  0.00000000  0.20798100  0.50000000  1.0
  I  I42  1  0.50000000  0.33004900  0.59705700  1.0
  I  I43  1  0.50000000  0.79201900  0.00000000  1.0
  I  I44  1  0.00000000  0.42977800  0.29866100  1.0
  I  I45  1  0.50000000  0.57022200  0.79866100  1.0