# generated using pymatgen
data_LuSc(B3Mo)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.11364283
_cell_length_b   5.32444001
_cell_length_c   6.67561668
_cell_angle_alpha   79.26749863
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuSc(B3Mo)2
_chemical_formula_sum   'Lu1 Sc1 B6 Mo2'
_cell_volume   108.73513962
_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
  Lu  Lu0  1  0.25000000  0.32282629  0.70738663  1.0
  Sc  Sc1  1  0.75000000  0.68859118  0.28123815  1.0
  B  B2  1  0.25000000  0.90671470  0.52172650  1.0
  B  B3  1  0.75000000  0.07394297  0.47653976  1.0
  B  B4  1  0.25000000  0.91374019  0.00753840  1.0
  B  B5  1  0.75000000  0.08960172  0.99614405  1.0
  B  B6  1  0.25000000  0.58517607  0.01176437  1.0
  B  B7  1  0.75000000  0.41814680  0.99425505  1.0
  Mo  Mo8  1  0.25000000  0.19352442  0.22428984  1.0
  Mo  Mo9  1  0.75000000  0.80773365  0.77911623  1.0