# generated using pymatgen
data_HfBe2(Nb3Sn2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.28375322
_cell_length_b   8.26214677
_cell_length_c   5.53471385
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.08574468
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfBe2(Nb3Sn2)3
_chemical_formula_sum   'Hf1 Be2 Nb9 Sn6'
_cell_volume   327.77058373
_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
  Hf  Hf0  1  0.75383632  0.00000060  0.75000000  1.0
  Be  Be1  1  0.00571397  0.99999407  0.01613069  1.0
  Be  Be2  1  0.00571397  0.99999407  0.48386931  1.0
  Nb  Nb3  1  0.33416293  0.66751216  0.00011562  1.0
  Nb  Nb4  1  0.66665179  0.33249240  0.49988506  1.0
  Nb  Nb5  1  0.66665179  0.33249240  0.00011494  1.0
  Nb  Nb6  1  0.33416293  0.66751216  0.49988438  1.0
  Nb  Nb7  1  0.25641155  0.00000468  0.25000000  1.0
  Nb  Nb8  1  0.24149109  0.24597736  0.75000000  1.0
  Nb  Nb9  1  0.99551022  0.75401798  0.75000000  1.0
  Nb  Nb10  1  0.99984111  0.25138526  0.25000000  1.0
  Nb  Nb11  1  0.74844326  0.74860822  0.25000000  1.0
  Sn  Sn12  1  0.60808691  0.00000197  0.25000000  1.0
  Sn  Sn13  1  0.60145991  0.60047862  0.75000000  1.0
  Sn  Sn14  1  0.00098510  0.39952215  0.75000000  1.0
  Sn  Sn15  1  0.99993538  0.60823706  0.25000000  1.0
  Sn  Sn16  1  0.39169556  0.39176597  0.25000000  1.0
  Sn  Sn17  1  0.38924621  0.00000289  0.75000000  1.0