# generated using pymatgen
data_LiMn2(BO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.07026900
_cell_length_b   9.09624001
_cell_length_c   11.47528173
_cell_angle_alpha   67.85675255
_cell_angle_beta   68.32245111
_cell_angle_gamma   60.79730523
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn2(BO3)2
_chemical_formula_sum   'Li6 Mn12 B12 O36'
_cell_volume   745.06683401
_cell_formula_units_Z   6
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  0.33955100  0.35907400  0.08432800  1
  Li  Li1  1  0.21064600  0.17618800  0.59290200  1
  Li  Li2  1  0.84408000  0.80697200  0.34840800  1
  Li  Li3  1  0.67668000  0.68513100  0.82308800  1
  Li  Li4  1  0.00023300  0.02129300  0.83020200  1
  Li  Li5  1  0.53253400  0.50906300  0.32227200  1
  Mn  Mn6  1  0.62113400  0.32140000  0.85613100  1
  Mn  Mn7  1  0.85391700  0.12709900  0.37021800  1
  Mn  Mn8  1  0.55100000  0.17988000  0.62292000  1
  Mn  Mn9  1  0.02795300  0.62743900  0.87421600  1
  Mn  Mn10  1  0.32441700  0.02358000  0.87010000  1
  Mn  Mn11  1  0.16693900  0.47108200  0.36842900  1
  Mn  Mn12  1  0.83933900  0.50584300  0.61686400  1
  Mn  Mn13  1  0.70446000  0.00260400  0.11187000  1
  Mn  Mn14  1  0.95734000  0.36907800  0.12478900  1
  Mn  Mn15  1  0.45839300  0.88099900  0.37315700  1
  Mn  Mn16  1  0.16034300  0.84529600  0.61474600  1
  Mn  Mn17  1  0.34598000  0.69657800  0.11719400  1
  B  B18  1  0.30474800  0.66683800  0.88563600  1
  B  B19  1  0.50164500  0.14746200  0.39558300  1
  B  B20  1  0.16954000  0.80488100  0.36062500  1
  B  B21  1  0.17940200  0.48315200  0.64134500  1
  B  B22  1  0.69516600  0.97197900  0.86004600  1
  B  B23  1  0.96103600  0.33389200  0.86461500  1
  B  B24  1  0.03121500  0.65776500  0.12968600  1
  B  B25  1  0.32852600  0.04094200  0.13134200  1
  B  B26  1  0.85976600  0.17618100  0.62042700  1
  B  B27  1  0.79618300  0.51453400  0.36639100  1
  B  B28  1  0.50185500  0.85821500  0.62388500  1
  B  B29  1  0.66621200  0.33883400  0.12441800  1
  O  O30  1  0.75932500  0.04793200  0.90518000  1
  O  O31  1  0.80476900  0.08890600  0.57849400  1
  O  O32  1  0.37172700  0.49493900  0.89511100  1
  O  O33  1  0.54243700  0.09152300  0.81270000  1
  O  O34  1  0.15131100  0.77511500  0.83872800  1
  O  O35  1  0.57480900  0.22731200  0.43076700  1
  O  O36  1  0.34281200  0.37833300  0.65400800  1
  O  O37  1  0.60281600  0.27025700  0.07485800  1
  O  O38  1  0.28694000  0.65882000  0.30870100  1
  O  O39  1  0.41700500  0.01069500  0.66683900  1
  O  O40  1  0.08970000  0.63213100  0.69102500  1
  O  O41  1  0.98413700  0.41616800  0.93482400  1
  O  O42  1  0.32966100  0.21565800  0.40124400  1
  O  O43  1  0.99821500  0.87206000  0.36843900  1
  O  O44  1  0.09624400  0.44975400  0.57931700  1
  O  O45  1  0.76912400  0.80222600  0.86376500  1
  O  O46  1  0.19358600  0.56008400  0.16061500  1
  O  O47  1  0.07032200  0.17148900  0.85408300  1
  O  O48  1  0.81619900  0.43603000  0.80792400  1
  O  O49  1  0.22086800  0.20966500  0.12409000  1
  O  O50  1  0.91842000  0.80525600  0.16615800  1
  O  O51  1  0.89036400  0.54323400  0.42650600  1
  O  O52  1  0.02554600  0.10030400  0.63517900  1
  O  O53  1  0.65984300  0.73871200  0.64616600  1
  O  O54  1  0.98661300  0.58946900  0.06213100  1
  O  O55  1  0.61167200  0.99246100  0.35548100  1
  O  O56  1  0.88945800  0.36889700  0.31118300  1
  O  O57  1  0.73816400  0.33414600  0.64916000  1
  O  O58  1  0.37373500  0.74462200  0.92612900  1
  O  O59  1  0.63184700  0.62208900  0.36132000  1
  O  O60  1  0.41371000  0.83184000  0.56075300  1
  O  O61  1  0.47311700  0.96065600  0.18687300  1
  O  O62  1  0.82768500  0.23168300  0.16240800  1
  O  O63  1  0.58184800  0.50352000  0.14044500  1
  O  O64  1  0.23325100  0.87325900  0.41075900  1
  O  O65  1  0.30772200  0.94270700  0.07393600  1
