# generated using pymatgen
data_Hf2Ta4NbH16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.44934319
_cell_length_b   6.33695688
_cell_length_c   6.44934381
_cell_angle_alpha   60.57478181
_cell_angle_beta   58.85043055
_cell_angle_gamma   60.57478600
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2Ta4NbH16
_chemical_formula_sum   'Hf2 Ta4 Nb1 H16'
_cell_volume   186.26764921
_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  0.50000000  0.00000000  0.50000000  1.0
  Hf  Hf1  1  0.00000000  0.50000000  0.00000000  1.0
  Ta  Ta2  1  0.00000000  0.00000000  0.50000000  1.0
  Ta  Ta3  1  0.00000000  0.50000000  0.50000000  1.0
  Ta  Ta4  1  0.50000000  0.50000000  0.00000000  1.0
  Ta  Ta5  1  0.50000000  0.00000000  0.00000000  1.0
  Nb  Nb6  1  0.00000000  0.00000000  0.00000000  1.0
  H  H7  1  0.88267289  0.87057752  0.37616907  1.0
  H  H8  1  0.87057752  0.37616907  0.87057752  1.0
  H  H9  1  0.37616907  0.87057752  0.88267289  1.0
  H  H10  1  0.87057752  0.88267289  0.87057752  1.0
  H  H11  1  0.11732711  0.12942248  0.62383093  1.0
  H  H12  1  0.12942248  0.62383093  0.12942248  1.0
  H  H13  1  0.62383093  0.12942248  0.11732711  1.0
  H  H14  1  0.12942248  0.11732711  0.12942248  1.0
  H  H15  1  0.61127261  0.62826617  0.13219504  1.0
  H  H16  1  0.62826617  0.13219504  0.62826617  1.0
  H  H17  1  0.13219504  0.62826617  0.61127261  1.0
  H  H18  1  0.62826617  0.61127261  0.62826617  1.0
  H  H19  1  0.38872739  0.37173383  0.86780496  1.0
  H  H20  1  0.37173383  0.86780496  0.37173383  1.0
  H  H21  1  0.86780496  0.37173383  0.38872739  1.0
  H  H22  1  0.37173383  0.38872739  0.37173383  1.0