# generated using pymatgen
data_Ta6MoH16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.29761283
_cell_length_b   6.29761314
_cell_length_c   6.29761449
_cell_angle_alpha   60.00000325
_cell_angle_beta   60.00000161
_cell_angle_gamma   60.00000869
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta6MoH16
_chemical_formula_sum   'Ta6 Mo1 H16'
_cell_volume   176.60909051
_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
  Ta  Ta0  1  0.00000000  0.00000000  0.50000000  1.0
  Ta  Ta1  1  0.50000000  0.00000000  0.50000000  1.0
  Ta  Ta2  1  0.00000000  0.50000000  0.50000000  1.0
  Ta  Ta3  1  0.50000000  0.50000000  0.00000000  1.0
  Ta  Ta4  1  0.00000000  0.50000000  0.00000000  1.0
  Ta  Ta5  1  0.50000000  0.00000000  0.00000000  1.0
  Mo  Mo6  1  0.00000000  0.00000000  0.00000000  1.0
  H  H7  1  0.87732285  0.87732285  0.36803044  1.0
  H  H8  1  0.87732285  0.36803044  0.87732285  1.0
  H  H9  1  0.36803044  0.87732285  0.87732285  1.0
  H  H10  1  0.87732285  0.87732285  0.87732285  1.0
  H  H11  1  0.12267715  0.12267715  0.63196956  1.0
  H  H12  1  0.12267715  0.63196956  0.12267715  1.0
  H  H13  1  0.63196956  0.12267715  0.12267715  1.0
  H  H14  1  0.12267715  0.12267715  0.12267715  1.0
  H  H15  1  0.62030615  0.62030615  0.13908156  1.0
  H  H16  1  0.62030615  0.13908156  0.62030615  1.0
  H  H17  1  0.13908156  0.62030615  0.62030615  1.0
  H  H18  1  0.62030615  0.62030615  0.62030615  1.0
  H  H19  1  0.37969385  0.37969385  0.86091844  1.0
  H  H20  1  0.37969385  0.86091844  0.37969385  1.0
  H  H21  1  0.86091844  0.37969385  0.37969385  1.0
  H  H22  1  0.37969385  0.37969385  0.37969385  1.0