# generated using pymatgen
data_BaNaLi3(BO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.39910612
_cell_length_b   8.39910612
_cell_length_c   8.39910582
_cell_angle_alpha   69.38327054
_cell_angle_beta   69.38327054
_cell_angle_gamma   69.38327115
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaNaLi3(BO2)6
_chemical_formula_sum   'Ba2 Na2 Li6 B12 O24'
_cell_volume   501.14250699
_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
  Ba  Ba0  1  0.85236100  0.85236100  0.85236100  1
  Ba  Ba1  1  0.14763900  0.14763900  0.14763900  1
  Na  Na2  1  0.66863200  0.66863200  0.66863200  1
  Na  Na3  1  0.33136800  0.33136800  0.33136800  1
  Li  Li4  1  0.78268800  0.59852600  0.27993600  1
  Li  Li5  1  0.27993600  0.78268800  0.59852600  1
  Li  Li6  1  0.59852600  0.27993600  0.78268800  1
  Li  Li7  1  0.21731200  0.40147400  0.72006400  1
  Li  Li8  1  0.72006400  0.21731200  0.40147400  1
  Li  Li9  1  0.40147400  0.72006400  0.21731200  1
  B  B10  1  0.69286500  0.48463300  0.06735700  1
  B  B11  1  0.06735700  0.69286500  0.48463300  1
  B  B12  1  0.48463300  0.06735700  0.69286500  1
  B  B13  1  0.30713500  0.51536700  0.93264300  1
  B  B14  1  0.93264300  0.30713500  0.51536700  1
  B  B15  1  0.51536700  0.93264300  0.30713500  1
  B  B16  1  0.13251200  0.68607800  0.16660000  1
  B  B17  1  0.16660000  0.13251200  0.68607800  1
  B  B18  1  0.68607800  0.16660000  0.13251200  1
  B  B19  1  0.86748800  0.31392200  0.83340000  1
  B  B20  1  0.83340000  0.86748800  0.31392200  1
  B  B21  1  0.31392200  0.83340000  0.86748800  1
  O  O22  1  0.90375000  0.80994800  0.47074600  1
  O  O23  1  0.47074600  0.90375000  0.80994800  1
  O  O24  1  0.80994800  0.47074600  0.90375000  1
  O  O25  1  0.09625000  0.19005200  0.52925400  1
  O  O26  1  0.52925400  0.09625000  0.19005200  1
  O  O27  1  0.19005200  0.52925400  0.09625000  1
  O  O28  1  0.65768100  0.82305000  0.37809100  1
  O  O29  1  0.37809100  0.65768100  0.82305000  1
  O  O30  1  0.82305000  0.37809100  0.65768100  1
  O  O31  1  0.34231900  0.17695000  0.62190900  1
  O  O32  1  0.62190900  0.34231900  0.17695000  1
  O  O33  1  0.17695000  0.62190900  0.34231900  1
  O  O34  1  0.94291500  0.76005800  0.18646600  1
  O  O35  1  0.18646600  0.94291500  0.76005800  1
  O  O36  1  0.76005800  0.18646600  0.94291500  1
  O  O37  1  0.05708500  0.23994200  0.81353400  1
  O  O38  1  0.81353400  0.05708500  0.23994200  1
  O  O39  1  0.23994200  0.81353400  0.05708500  1
  O  O40  1  0.65178400  0.63316100  0.11797700  1
  O  O41  1  0.11797700  0.65178400  0.63316100  1
  O  O42  1  0.63316100  0.11797700  0.65178400  1
  O  O43  1  0.34821600  0.36683900  0.88202300  1
  O  O44  1  0.88202300  0.34821600  0.36683900  1
  O  O45  1  0.36683900  0.88202300  0.34821600  1
