# generated using pymatgen
data_Lu5Si3B
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.33378653
_cell_length_b   8.33378653
_cell_length_c   6.16425300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000422
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu5Si3B
_chemical_formula_sum   'Lu10 Si6 B2'
_cell_volume   370.76250884
_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
  Lu  Lu0  1  0.76130000  0.76130000  0.25000000  1.0
  Lu  Lu1  1  0.76130000  0.00000000  0.75000000  1.0
  Lu  Lu2  1  0.00000000  0.23870000  0.25000000  1.0
  Lu  Lu3  1  0.00000000  0.76130000  0.75000000  1.0
  Lu  Lu4  1  0.23870000  0.23870000  0.75000000  1.0
  Lu  Lu5  1  0.23870000  0.00000000  0.25000000  1.0
  Lu  Lu6  1  0.66666700  0.33333300  0.00000000  1.0
  Lu  Lu7  1  0.33333300  0.66666700  0.50000000  1.0
  Lu  Lu8  1  0.33333300  0.66666700  0.00000000  1.0
  Lu  Lu9  1  0.66666700  0.33333300  0.50000000  1.0
  Si  Si10  1  0.40068600  0.00000000  0.75000000  1.0
  Si  Si11  1  0.40068600  0.40068600  0.25000000  1.0
  Si  Si12  1  0.00000000  0.59931400  0.25000000  1.0
  Si  Si13  1  0.00000000  0.40068600  0.75000000  1.0
  Si  Si14  1  0.59931400  0.59931400  0.75000000  1.0
  Si  Si15  1  0.59931400  0.00000000  0.25000000  1.0
  B  B16  1  0.00000000  0.00000000  0.50000000  1.0
  B  B17  1  0.00000000  0.00000000  0.00000000  1.0