# generated using pymatgen
data_Li2Ni3(BO3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.07849900
_cell_length_b   8.10327900
_cell_length_c   8.10838210
_cell_angle_alpha   60.14935192
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Ni3(BO3)3
_chemical_formula_sum   'Li4 Ni6 B6 O18'
_cell_volume   346.39659460
_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  0.50000000  0.69711800  0.27985900  1
  Li  Li1  1  0.00000000  0.27927700  0.02157800  1
  Li  Li2  1  0.00000000  0.02520300  0.69881500  1
  Li  Li3  1  0.50000000  0.02363500  0.69964700  1
  Ni  Ni4  1  0.24966900  0.98518100  0.37640000  1
  Ni  Ni5  1  0.75033100  0.98518100  0.37640000  1
  Ni  Ni6  1  0.24917500  0.38424500  0.63325400  1
  Ni  Ni7  1  0.75082500  0.38424500  0.63325400  1
  Ni  Ni8  1  0.25048200  0.62875300  0.98997400  1
  Ni  Ni9  1  0.74951800  0.62875300  0.98997400  1
  B  B10  1  0.50000000  0.33336600  0.33431300  1
  B  B11  1  0.00000000  0.33075100  0.33640900  1
  B  B12  1  0.25125100  0.00132400  0.99571200  1
  B  B13  1  0.74874900  0.00132400  0.99571200  1
  B  B14  1  0.00000000  0.66836800  0.67013500  1
  B  B15  1  0.50000000  0.66864100  0.66410300  1
  O  O16  1  0.73404600  0.80550100  0.09135400  1
  O  O17  1  0.26595400  0.80550100  0.09135400  1
  O  O18  1  0.50000000  0.78484000  0.46617400  1
  O  O19  1  0.00000000  0.78345200  0.47548100  1
  O  O20  1  0.50000000  0.45739300  0.14117600  1
  O  O21  1  0.00000000  0.44702900  0.14074800  1
  O  O22  1  0.23461100  0.09228900  0.09960700  1
  O  O23  1  0.76538900  0.09228900  0.09960700  1
  O  O24  1  0.00000000  0.74821400  0.78848100  1
  O  O25  1  0.50000000  0.74952400  0.78065000  1
  O  O26  1  0.50000000  0.41137600  0.45311400  1
  O  O27  1  0.00000000  0.40016800  0.46012200  1
  O  O28  1  0.00000000  0.13405500  0.41283800  1
  O  O29  1  0.50000000  0.13784200  0.41226500  1
  O  O30  1  0.00000000  0.47093200  0.75134600  1
  O  O31  1  0.50000000  0.47378300  0.74224300  1
  O  O32  1  0.25092100  0.10031800  0.79873600  1
  O  O33  1  0.74907900  0.10031800  0.79873600  1
