# generated using pymatgen
data_Li3CrB4O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.54380300
_cell_length_b   5.89267600
_cell_length_c   6.70440179
_cell_angle_alpha   76.61829052
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3CrB4O9
_chemical_formula_sum   'Li6 Cr2 B8 O18'
_cell_volume   328.37464779
_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  0.43560500  0.76208100  0.16008000  1
  Li  Li1  1  0.06439500  0.76208100  0.16008000  1
  Li  Li2  1  0.75000000  0.58569100  0.50187500  1
  Li  Li3  1  0.25000000  0.41430900  0.49812500  1
  Li  Li4  1  0.93560500  0.23791900  0.83992000  1
  Li  Li5  1  0.56439500  0.23791900  0.83992000  1
  Cr  Cr6  1  0.75000000  0.75164300  0.88701200  1
  Cr  Cr7  1  0.25000000  0.24835700  0.11298800  1
  B  B8  1  0.75000000  0.99838000  0.23128300  1
  B  B9  1  0.25000000  0.86394400  0.45883600  1
  B  B10  1  0.45741900  0.71727600  0.71674100  1
  B  B11  1  0.04258100  0.71727600  0.71674100  1
  B  B12  1  0.95741900  0.28272400  0.28325900  1
  B  B13  1  0.54258100  0.28272400  0.28325900  1
  B  B14  1  0.75000000  0.13605600  0.54116400  1
  B  B15  1  0.25000000  0.00162000  0.76871700  1
  O  O16  1  0.39586000  0.85433700  0.84279000  1
  O  O17  1  0.10414000  0.85433700  0.84279000  1
  O  O18  1  0.75000000  0.93341800  0.45373800  1
  O  O19  1  0.25000000  0.91982800  0.23602900  1
  O  O20  1  0.38945100  0.70955700  0.53210900  1
  O  O21  1  0.11054900  0.70955700  0.53210900  1
  O  O22  1  0.75000000  0.78836000  0.15517800  1
  O  O23  1  0.91107500  0.58294500  0.77824500  1
  O  O24  1  0.58892500  0.58294500  0.77824500  1
  O  O25  1  0.08892500  0.41705500  0.22175500  1
  O  O26  1  0.41107500  0.41705500  0.22175500  1
  O  O27  1  0.25000000  0.21164000  0.84482200  1
  O  O28  1  0.88945100  0.29044300  0.46789100  1
  O  O29  1  0.61054900  0.29044300  0.46789100  1
  O  O30  1  0.75000000  0.08017200  0.76397100  1
  O  O31  1  0.25000000  0.06658200  0.54626200  1
  O  O32  1  0.89586000  0.14566300  0.15721000  1
  O  O33  1  0.60414000  0.14566300  0.15721000  1
