# generated using pymatgen
data_LiLa(NdB12)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.14992881
_cell_length_b   7.14992963
_cell_length_c   5.86159752
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   109.32110267
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiLa(NdB12)2
_chemical_formula_sum   'Li1 La1 Nd2 B24'
_cell_volume   282.77684320
_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
  Li  Li0  1  0.74748063  0.25251937  0.50000000  1.0
  La  La1  1  0.99769008  0.00230992  0.00000000  1.0
  Nd  Nd2  1  0.50206220  0.49793780  0.00000000  1.0
  Nd  Nd3  1  0.25096635  0.74903365  0.50000000  1.0
  B  B4  1  0.17528893  0.32566011  0.64883105  1.0
  B  B5  1  0.92495171  0.57434117  0.14990795  1.0
  B  B6  1  0.67433989  0.82471107  0.64883105  1.0
  B  B7  1  0.42565883  0.07504829  0.14990795  1.0
  B  B8  1  0.17528893  0.32566011  0.35116895  1.0
  B  B9  1  0.92495171  0.57434117  0.85009205  1.0
  B  B10  1  0.67433989  0.82471107  0.35116895  1.0
  B  B11  1  0.42565883  0.07504829  0.85009205  1.0
  B  B12  1  0.40138136  0.39857017  0.50000000  1.0
  B  B13  1  0.14961886  0.64982733  0.00000000  1.0
  B  B14  1  0.89833569  0.90050297  0.50000000  1.0
  B  B15  1  0.64969763  0.14946675  0.00000000  1.0
  B  B16  1  0.32581734  0.17514683  0.64890430  1.0
  B  B17  1  0.07505250  0.42539517  0.14992544  1.0
  B  B18  1  0.82485317  0.67418266  0.64890430  1.0
  B  B19  1  0.57460483  0.92494750  0.14992544  1.0
  B  B20  1  0.09949703  0.10166431  0.50000000  1.0
  B  B21  1  0.85053325  0.35030237  0.00000000  1.0
  B  B22  1  0.60142983  0.59861864  0.50000000  1.0
  B  B23  1  0.35017267  0.85038114  0.00000000  1.0
  B  B24  1  0.32581734  0.17514683  0.35109570  1.0
  B  B25  1  0.07505250  0.42539517  0.85007456  1.0
  B  B26  1  0.82485317  0.67418266  0.35109570  1.0
  B  B27  1  0.57460483  0.92494750  0.85007456  1.0