# generated using pymatgen
data_Li3Al(BO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.91906900
_cell_length_b   6.32850474
_cell_length_c   8.04566506
_cell_angle_alpha   73.47730043
_cell_angle_beta   89.05525673
_cell_angle_gamma   89.09596913
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Al(BO3)2
_chemical_formula_sum   'Li6 Al2 B4 O12'
_cell_volume   240.07328427
_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  0.82999000  0.23674600  0.61141800  1
  Li  Li1  1  0.68141900  0.39755600  0.92935200  1
  Li  Li2  1  0.82349300  0.53088600  0.26162500  1
  Li  Li3  1  0.17650700  0.46911400  0.73837500  1
  Li  Li4  1  0.17001000  0.76325400  0.38858200  1
  Li  Li5  1  0.31858100  0.60244400  0.07064800  1
  Al  Al6  1  0.64996400  0.05548800  0.27485800  1
  Al  Al7  1  0.35003600  0.94451200  0.72514200  1
  B  B8  1  0.83497900  0.82373800  0.90729900  1
  B  B9  1  0.16502100  0.17626200  0.09270100  1
  B  B10  1  0.34239600  0.32112300  0.43004600  1
  B  B11  1  0.65760400  0.67887700  0.56995400  1
  O  O12  1  0.28990500  0.33930700  0.97030600  1
  O  O13  1  0.71009500  0.66069300  0.02969400  1
  O  O14  1  0.38830100  0.74277800  0.60533700  1
  O  O15  1  0.61169900  0.25722200  0.39466300  1
  O  O16  1  0.21159500  0.49229600  0.32104600  1
  O  O17  1  0.78840500  0.50770400  0.67895400  1
  O  O18  1  0.11905900  0.83656400  0.89435300  1
  O  O19  1  0.88094100  0.16343600  0.10564700  1
  O  O20  1  0.22741300  0.20357600  0.59052400  1
  O  O21  1  0.77258700  0.79642400  0.40947600  1
  O  O22  1  0.68669700  0.98183200  0.78194000  1
  O  O23  1  0.31330300  0.01816800  0.21806000  1
