# generated using pymatgen
data_CsAlH2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.83927900
_cell_length_b   6.83927900
_cell_length_c   8.27983029
_cell_angle_alpha   114.39395492
_cell_angle_beta   114.39395492
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CsAlH2
_chemical_formula_sum   'Cs4 Al4 H8'
_cell_volume   314.36541661
_cell_formula_units_Z   4
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
  Cs  Cs0  1  0.62500000  0.87500000  0.25000000  1.0
  Cs  Cs1  1  0.62500000  0.37500000  0.25000000  1.0
  Cs  Cs2  1  0.62500000  0.37500000  0.75000000  1.0
  Cs  Cs3  1  0.12500000  0.37500000  0.75000000  1.0
  Al  Al4  1  0.12500000  0.37500000  0.25000000  1.0
  Al  Al5  1  0.12500000  0.87500000  0.25000000  1.0
  Al  Al6  1  0.12500000  0.87500000  0.75000000  1.0
  Al  Al7  1  0.62500000  0.87500000  0.75000000  1.0
  H  H8  1  0.31030900  0.15965100  0.31149200  1.0
  H  H9  1  0.00118300  0.15184100  0.31149200  1.0
  H  H10  1  0.40184100  0.06030900  0.81149200  1.0
  H  H11  1  0.93969100  0.59034900  0.18850800  1.0
  H  H12  1  0.40965100  0.75118300  0.81149200  1.0
  H  H13  1  0.24881700  0.59815900  0.18850800  1.0
  H  H14  1  0.84815900  0.68969100  0.68850800  1.0
  H  H15  1  0.84034900  0.99881700  0.68850800  1.0