# generated using pymatgen
data_NdEr3(BeSi3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.81244406
_cell_length_b   7.81244442
_cell_length_c   8.14034193
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999849
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdEr3(BeSi3)2
_chemical_formula_sum   'Nd2 Er6 Be4 Si12'
_cell_volume   430.27602397
_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
  Nd  Nd0  1  0.00000000  0.00000000  0.25000000  1.0
  Nd  Nd1  1  0.00000000  0.00000000  0.75000000  1.0
  Er  Er2  1  0.49993611  0.50006389  0.25000000  1.0
  Er  Er3  1  0.49993611  0.99987122  0.25000000  1.0
  Er  Er4  1  0.00012878  0.50006389  0.25000000  1.0
  Er  Er5  1  0.50006389  0.49993611  0.75000000  1.0
  Er  Er6  1  0.99987122  0.49993611  0.75000000  1.0
  Er  Er7  1  0.50006389  0.00012878  0.75000000  1.0
  Be  Be8  1  0.66666700  0.33333300  0.49788810  1.0
  Be  Be9  1  0.66666700  0.33333300  0.00211190  1.0
  Be  Be10  1  0.33333300  0.66666700  0.99788810  1.0
  Be  Be11  1  0.33333300  0.66666700  0.50211190  1.0
  Si  Si12  1  0.82665657  0.17334343  0.49997951  1.0
  Si  Si13  1  0.82665657  0.65331414  0.49997951  1.0
  Si  Si14  1  0.34668586  0.17334343  0.49997951  1.0
  Si  Si15  1  0.82665657  0.17334343  0.00002049  1.0
  Si  Si16  1  0.82665657  0.65331414  0.00002049  1.0
  Si  Si17  1  0.34668586  0.17334343  0.00002049  1.0
  Si  Si18  1  0.17334343  0.82665657  0.99997951  1.0
  Si  Si19  1  0.65331414  0.82665657  0.99997951  1.0
  Si  Si20  1  0.17334343  0.34668586  0.99997951  1.0
  Si  Si21  1  0.17334343  0.82665657  0.50002049  1.0
  Si  Si22  1  0.65331414  0.82665657  0.50002049  1.0
  Si  Si23  1  0.17334343  0.34668586  0.50002049  1.0