# generated using pymatgen
data_NaAlH4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.94110149
_cell_length_b   4.94110073
_cell_length_c   6.51151782
_cell_angle_alpha   112.29727348
_cell_angle_beta   112.29727533
_cell_angle_gamma   90.00000306
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaAlH4
_chemical_formula_sum   'Na2 Al2 H8'
_cell_volume   134.15226902
_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
  Na  Na0  1  0.12500000  0.37500000  0.25000000  1.0
  Na  Na1  1  0.87500000  0.62500000  0.75000000  1.0
  Al  Al2  1  0.62500000  0.87500000  0.25000000  1.0
  Al  Al3  1  0.37500000  0.12500000  0.75000000  1.0
  H  H4  1  0.69250912  0.34820834  0.91204458  1.0
  H  H5  1  0.56383824  0.19250912  0.41204458  1.0
  H  H6  1  0.84820834  0.71953646  0.41204458  1.0
  H  H7  1  0.21953646  0.06383824  0.91204458  1.0
  H  H8  1  0.78046354  0.93616176  0.08795542  1.0
  H  H9  1  0.15179166  0.28046354  0.58795542  1.0
  H  H10  1  0.43616076  0.80749088  0.58795542  1.0
  H  H11  1  0.30749088  0.65179166  0.08795542  1.0