# generated using pymatgen
data_La2B3Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.81691022
_cell_length_b   7.81690323
_cell_length_c   8.22854091
_cell_angle_alpha   89.99908036
_cell_angle_beta   89.99687376
_cell_angle_gamma   119.99978289
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2B3Cl
_chemical_formula_sum   'La8 B12 Cl4'
_cell_volume   435.43594039
_cell_formula_units_Z   4
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  0.50034081  0.00120373  0.22610404  1.0
  La  La1  1  0.50043389  0.00126310  0.77386237  1.0
  La  La2  1  0.50082306  0.49957256  0.22611114  1.0
  La  La3  1  0.99864138  0.49919824  0.22616153  1.0
  La  La4  1  0.50088933  0.49967276  0.77388195  1.0
  La  La5  1  0.99880020  0.49911311  0.77388674  1.0
  La  La6  1  0.00000044  -0.00000243  0.24016698  1.0
  La  La7  1  -0.00000424  -0.00000183  0.75980998  1.0
  B  B8  1  0.52550790  0.26279543  0.00000242  1.0
  B  B9  1  0.26291708  0.52567814  0.00003336  1.0
  B  B10  1  0.72107477  0.86057603  0.00000675  1.0
  B  B11  1  0.86099510  0.13907990  0.00000499  1.0
  B  B12  1  0.27809692  0.13901028  0.00001233  1.0
  B  B13  1  0.26276504  0.73707535  0.00000608  1.0
  B  B14  1  0.73720716  0.26270378  0.00001124  1.0
  B  B15  1  0.13951190  0.27893171  0.00000048  1.0
  B  B16  1  0.47432550  0.73723395  0.00002238  1.0
  B  B17  1  0.86092918  0.72191152  0.00000625  1.0
  B  B18  1  0.73728844  0.47449804  -0.00003103  1.0
  B  B19  1  0.13943110  0.86049263  0.00001045  1.0
  Cl  Cl20  1  0.33813491  0.17013793  0.49998782  1.0
  Cl  Cl21  1  0.83201383  0.66187040  0.49998870  1.0
  Cl  Cl22  1  0.82986424  0.16798504  0.49998070  1.0
  Cl  Cl23  1  0.33334505  0.66666664  0.49997237  1.0