# generated using pymatgen
data_Li6Mn5Fe(BO3)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.27309800
_cell_length_b   8.27603239
_cell_length_c   12.72996895
_cell_angle_alpha   89.93297471
_cell_angle_beta   90.16870139
_cell_angle_gamma   119.95158997
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Mn5Fe(BO3)6
_chemical_formula_sum   'Li12 Mn10 Fe2 B12 O36'
_cell_volume   755.19318972
_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  0.71609300  0.69859600  0.87497400  1
  Li  Li1  1  0.71592200  0.69832000  0.12489200  1
  Li  Li2  1  0.71609000  0.69838500  0.37524000  1
  Li  Li3  1  0.71622900  0.69855300  0.62480500  1
  Li  Li4  1  0.98284000  0.28406300  0.87500000  1
  Li  Li5  1  0.98334200  0.28469500  0.62482900  1
  Li  Li6  1  0.98317200  0.28479400  0.37489800  1
  Li  Li7  1  0.98280600  0.28365500  0.12516100  1
  Li  Li8  1  0.30167000  0.01759100  0.62517900  1
  Li  Li9  1  0.30187400  0.01714500  0.37488100  1
  Li  Li10  1  0.30121200  0.01733100  0.87503200  1
  Li  Li11  1  0.30138400  0.01679800  0.12517700  1
  Mn  Mn12  1  0.62890100  0.98818400  0.99998000  1
  Mn  Mn13  1  0.62784600  0.98796800  0.50008900  1
  Mn  Mn14  1  0.62880200  0.98810900  0.75003700  1
  Mn  Mn15  1  0.62782600  0.98803800  0.25018100  1
  Mn  Mn16  1  0.35954900  0.37111400  0.00004200  1
  Mn  Mn17  1  0.35919300  0.37107800  0.74866400  1
  Mn  Mn18  1  0.35985300  0.37188200  0.25134100  1
  Mn  Mn19  1  0.01204900  0.63958500  0.49880400  1
  Mn  Mn20  1  0.01214500  0.64103000  0.00122000  1
  Mn  Mn21  1  0.01170700  0.64046900  0.75004700  1
  Fe  Fe22  1  0.35942400  0.36653000  0.49979800  1
  Fe  Fe23  1  0.00803100  0.64006300  0.24899400  1
  B  B24  1  0.99995300  0.00010200  0.00012500  1
  B  B25  1  0.99988000  0.99982200  0.74996600  1
  B  B26  1  0.00009600  0.00251200  0.49992900  1
  B  B27  1  0.00181600  0.99949300  0.25008400  1
  B  B28  1  0.66761500  0.33433700  0.12626900  1
  B  B29  1  0.66673300  0.33345400  0.87503600  1
  B  B30  1  0.66593100  0.33326800  0.62382500  1
  B  B31  1  0.66658000  0.33431300  0.37507000  1
  B  B32  1  0.33318700  0.66654700  0.87501400  1
  B  B33  1  0.33349100  0.66555400  0.62415300  1
  B  B34  1  0.33193300  0.66533500  0.37481000  1
  B  B35  1  0.33206000  0.66622000  0.12580600  1
  O  O36  1  0.88471100  0.80638600  0.74999000  1
  O  O37  1  0.88473200  0.80668800  0.00022700  1
  O  O38  1  0.88854100  0.80914000  0.49996600  1
  O  O39  1  0.88836500  0.80538400  0.25085800  1
  O  O40  1  0.86149700  0.44221200  0.12786900  1
  O  O41  1  0.86018900  0.44080400  0.87548500  1
  O  O42  1  0.85933300  0.44101300  0.62445100  1
  O  O43  1  0.85975900  0.44236500  0.37265000  1
  O  O44  1  0.92161600  0.11535300  0.00009500  1
  O  O45  1  0.92007800  0.11582400  0.49991900  1
  O  O46  1  0.92047900  0.11179200  0.25009900  1
  O  O47  1  0.92160900  0.11511400  0.74992400  1
  O  O48  1  0.55993300  0.41995900  0.12555600  1
  O  O49  1  0.55835700  0.41958700  0.37765500  1
  O  O50  1  0.55922800  0.41945400  0.87465700  1
  O  O51  1  0.55799900  0.41892700  0.62256600  1
  O  O52  1  0.58212700  0.14113100  0.12496100  1
  O  O53  1  0.58069000  0.14006800  0.87499500  1
  O  O54  1  0.58141400  0.14101300  0.37477800  1
  O  O55  1  0.58035300  0.13999400  0.62499200  1
  O  O56  1  0.52681200  0.77788700  0.87498400  1
  O  O57  1  0.52575600  0.77792700  0.37520000  1
  O  O58  1  0.52708900  0.77787100  0.62468600  1
  O  O59  1  0.52579800  0.77799000  0.12510700  1
  O  O60  1  0.19343300  0.07829200  0.00005800  1
  O  O61  1  0.19336500  0.07807300  0.74984300  1
  O  O62  1  0.19463300  0.08403500  0.49987200  1
  O  O63  1  0.19521600  0.07933200  0.25001800  1
  O  O64  1  0.22184600  0.74892300  0.87523100  1
  O  O65  1  0.22181200  0.74784500  0.62481300  1
  O  O66  1  0.21962300  0.74696000  0.37326900  1
  O  O67  1  0.21980900  0.74744500  0.12646600  1
  O  O68  1  0.25242600  0.47231300  0.62330800  1
  O  O69  1  0.25113600  0.47305100  0.87480200  1
  O  O70  1  0.25202200  0.47215900  0.37595300  1
  O  O71  1  0.25097500  0.47276000  0.12534100  1
