# generated using pymatgen
data_LiAlSi2H2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.91639686
_cell_length_b   6.95942673
_cell_length_c   7.65832193
_cell_angle_alpha   62.49676025
_cell_angle_beta   89.71421764
_cell_angle_gamma   68.81515487
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiAlSi2H2O7
_chemical_formula_sum   'Li2 Al2 Si4 H4 O14'
_cell_volume   298.97156661
_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
  Li  Li0  1  0.16335600  0.98831600  0.61584700  1
  Li  Li1  1  0.57239800  0.89867100  0.64005500  1
  Al  Al2  1  0.95813600  0.57595300  0.75310500  1
  Al  Al3  1  0.45205700  0.01586900  0.01806500  1
  Si  Si4  1  0.52449100  0.46977600  0.87709300  1
  Si  Si5  1  0.82295000  0.98945500  0.88286800  1
  Si  Si6  1  0.29094200  0.29769300  0.22660600  1
  Si  Si7  1  0.94842900  0.59840400  0.32453800  1
  H  H8  1  0.40699000  0.86529300  0.23085200  1
  H  H9  1  0.29333600  0.62326700  0.58591500  1
  H  H10  1  0.99891700  0.05219100  0.90270900  1
  H  H11  1  0.75298200  0.39964900  0.32449500  1
  O  O12  1  0.71726600  0.53298600  0.77752500  1
  O  O13  1  0.87855500  0.37081400  0.40646900  1
  O  O14  1  0.16686500  0.26466000  0.90402000  1
  O  O15  1  0.96742600  0.66257100  0.49640100  1
  O  O16  1  0.86233000  0.86379400  0.74453200  1
  O  O17  1  0.58470200  0.21092400  0.82155300  1
  O  O18  1  0.42261900  0.89307900  0.85571800  1
  O  O19  1  0.17136400  0.54007600  0.24172300  1
  O  O20  1  0.29095400  0.63536400  0.70831500  1
  O  O21  1  0.46495500  0.64052400  0.99758000  1
  O  O22  1  0.49031400  0.26294200  0.10361700  1
  O  O23  1  0.34254800  0.07675800  0.44040900  1
  O  O24  1  0.09023200  0.35987800  0.04644900  1
  O  O25  1  0.77818700  0.82059300  0.11174200  1
