# generated using pymatgen
data_Li5Fe6(BO3)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.05999648
_cell_length_b   9.05999698
_cell_length_c   11.33445113
_cell_angle_alpha   111.92071325
_cell_angle_beta   111.92071335
_cell_angle_gamma   59.79824576
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li5Fe6(BO3)6
_chemical_formula_sum   'Li10 Fe12 B12 O36'
_cell_volume   725.70394414
_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  0.00544600  0.99219600  0.83428100  1
  Li  Li1  1  0.13352200  0.14894800  0.58611900  1
  Li  Li2  1  0.14689000  0.17492400  0.33104200  1
  Li  Li3  1  0.34046100  0.32901300  0.83948200  1
  Li  Li4  1  0.31635900  0.31205600  0.10562500  1
  Li  Li5  1  0.49219600  0.50544600  0.33428100  1
  Li  Li6  1  0.67492400  0.64689000  0.83104200  1
  Li  Li7  1  0.64894800  0.63352200  0.08611900  1
  Li  Li8  1  0.81205600  0.81635900  0.60562500  1
  Li  Li9  1  0.82901300  0.84046100  0.33948200  1
  Fe  Fe10  1  0.02108400  0.34059200  0.87418100  1
  Fe  Fe11  1  0.16810700  0.48251600  0.61345100  1
  Fe  Fe12  1  0.17002200  0.84163100  0.36219300  1
  Fe  Fe13  1  0.34163100  0.67002200  0.86219300  1
  Fe  Fe14  1  0.30397100  0.97829300  0.11511900  1
  Fe  Fe15  1  0.47829300  0.80397100  0.61511900  1
  Fe  Fe16  1  0.50840200  0.16667000  0.36892300  1
  Fe  Fe17  1  0.66667000  0.00840200  0.86892300  1
  Fe  Fe18  1  0.67333200  0.30740000  0.12177800  1
  Fe  Fe19  1  0.80740000  0.17333200  0.62177800  1
  Fe  Fe20  1  0.84059200  0.52108400  0.37418100  1
  Fe  Fe21  1  0.98251600  0.66810700  0.11345100  1
  B  B22  1  0.00215200  0.68334000  0.86714800  1
  B  B23  1  0.14401300  0.83106900  0.62459400  1
  B  B24  1  0.18334000  0.50215200  0.36714800  1
  B  B25  1  0.34962000  0.01348800  0.87822800  1
  B  B26  1  0.33106900  0.64401300  0.12459400  1
  B  B27  1  0.48685200  0.14265000  0.62378000  1
  B  B28  1  0.51348800  0.84962000  0.37822800  1
  B  B29  1  0.68555900  0.34086100  0.87378900  1
  B  B30  1  0.64265000  0.98685200  0.12378000  1
  B  B31  1  0.83103000  0.48888200  0.62827800  1
  B  B32  1  0.84086200  0.18555900  0.37378800  1
  B  B33  1  0.98888200  0.33103000  0.12827800  1
  O  O34  1  0.02012400  0.10658300  0.39065300  1
  O  O35  1  0.16858500  0.57652000  0.83931400  1
  O  O36  1  0.07652000  0.66858500  0.33931400  1
  O  O37  1  0.26704300  0.94108800  0.90662100  1
  O  O38  1  0.11201200  0.42560900  0.40414900  1
  O  O39  1  0.28037700  0.19189700  0.89064600  1
  O  O40  1  0.07716200  0.16418100  0.14589700  1
  O  O41  1  0.21670800  0.90551300  0.58613500  1
  O  O42  1  0.05777800  0.40098200  0.08279500  1
  O  O43  1  0.24868100  0.67052900  0.65924100  1
  O  O44  1  0.17052900  0.74868100  0.15924100  1
  O  O45  1  0.31851800  0.23493500  0.64024400  1
  O  O46  1  0.35628600  0.41175400  0.35587200  1
  O  O47  1  0.51039700  0.90259300  0.84024000  1
  O  O48  1  0.40259300  0.01039700  0.34024000  1
  O  O49  1  0.44108800  0.76704300  0.40662100  1
  O  O50  1  0.60918700  0.25754100  0.90188300  1
  O  O51  1  0.60658300  0.52012400  0.89065300  1
  O  O52  1  0.41921300  0.47052700  0.13317700  1
  O  O53  1  0.40551300  0.71670800  0.08613500  1
  O  O54  1  0.55249800  0.19419700  0.55927000  1
  O  O55  1  0.60067300  0.99063300  0.67551100  1
  O  O56  1  0.49063300  0.10067300  0.17551100  1
  O  O57  1  0.66418100  0.57716200  0.64589700  1
  O  O58  1  0.69189700  0.78037700  0.39064600  1
  O  O59  1  0.84125000  0.23809000  0.83337100  1
  O  O60  1  0.73809000  0.34125000  0.33337100  1
  O  O61  1  0.92560900  0.61201200  0.90415000  1
  O  O62  1  0.75754100  0.10918700  0.40188300  1
  O  O63  1  0.91175400  0.85628600  0.85587200  1
  O  O64  1  0.73493500  0.81851800  0.14024400  1
  O  O65  1  0.90098200  0.55777800  0.58279500  1
  O  O66  1  0.69419700  0.05249800  0.05927000  1
  O  O67  1  0.93494300  0.32253200  0.65839800  1
  O  O68  1  0.82253200  0.43494300  0.15839800  1
  O  O69  1  0.97052700  0.91921300  0.63317700  1
