# generated using pymatgen
data_LiMn2(BO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.08453845
_cell_length_b   9.08453845
_cell_length_c   10.47190813
_cell_angle_alpha   89.62203001
_cell_angle_beta   89.62203001
_cell_angle_gamma   60.75019222
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn2(BO3)2
_chemical_formula_sum   'Li6 Mn12 B12 O36'
_cell_volume   754.02045349
_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  0.71646800  0.69769800  0.32371000  1
  Li  Li1  1  0.69769800  0.71646800  0.82371000  1
  Li  Li2  1  0.94584600  0.96399400  0.08402100  1
  Li  Li3  1  0.96399400  0.94584600  0.58402100  1
  Li  Li4  1  0.40516800  0.36482400  0.33101900  1
  Li  Li5  1  0.36482400  0.40516800  0.83101900  1
  Mn  Mn6  1  0.74705700  0.33493000  0.87482900  1
  Mn  Mn7  1  0.92483400  0.32972500  0.12337500  1
  Mn  Mn8  1  0.33493000  0.74705700  0.37482900  1
  Mn  Mn9  1  0.94863800  0.59739800  0.62106100  1
  Mn  Mn10  1  0.32972500  0.92483400  0.62337500  1
  Mn  Mn11  1  0.59739800  0.94863800  0.12106100  1
  Mn  Mn12  1  0.35707000  0.06985800  0.87944600  1
  Mn  Mn13  1  0.06985800  0.35707000  0.37944600  1
  Mn  Mn14  1  0.74701300  0.04460700  0.36587400  1
  Mn  Mn15  1  0.59818500  0.29809400  0.60699700  1
  Mn  Mn16  1  0.29809400  0.59818500  0.10699700  1
  Mn  Mn17  1  0.04460700  0.74701300  0.86587400  1
  B  B18  1  0.96099600  0.25031900  0.63404000  1
  B  B19  1  0.69510900  0.41294200  0.35659300  1
  B  B20  1  0.41294200  0.69510900  0.85659300  1
  B  B21  1  0.25031900  0.96099600  0.13404000  1
  B  B22  1  0.95346900  0.62231400  0.12715400  1
  B  B23  1  0.41192400  0.04172700  0.36977600  1
  B  B24  1  0.62231400  0.95346900  0.62715400  1
  B  B25  1  0.70214500  0.06214900  0.89151500  1
  B  B26  1  0.04172700  0.41192400  0.86977600  1
  B  B27  1  0.62854200  0.25819100  0.12452800  1
  B  B28  1  0.06214900  0.70214500  0.39151500  1
  B  B29  1  0.25819100  0.62854200  0.62452800  1
  O  O30  1  0.72135200  0.32555400  0.06264400  1
  O  O31  1  0.86209500  0.33827300  0.30414500  1
  O  O32  1  0.80048500  0.31594800  0.69310100  1
  O  O33  1  0.94483600  0.35175900  0.93363800  1
  O  O34  1  0.59624600  0.58137200  0.36027000  1
  O  O35  1  0.32555400  0.72135200  0.56264400  1
  O  O36  1  0.58137200  0.59624600  0.86027000  1
  O  O37  1  0.31594800  0.80048500  0.19310100  1
  O  O38  1  0.33827300  0.86209500  0.80414500  1
  O  O39  1  0.94935000  0.57139200  0.81020600  1
  O  O40  1  0.08305600  0.06637700  0.12434500  1
  O  O41  1  0.78327700  0.70659500  0.14621200  1
  O  O42  1  0.97094400  0.61972400  0.43146500  1
  O  O43  1  0.06637700  0.08305600  0.62434500  1
  O  O44  1  0.35175900  0.94483600  0.43363800  1
  O  O45  1  0.70659500  0.78327700  0.64621200  1
  O  O46  1  0.36648600  0.00141300  0.07801100  1
  O  O47  1  0.57139200  0.94935000  0.31020600  1
  O  O48  1  0.44979500  0.04607200  0.66321100  1
  O  O49  1  0.61972400  0.97094400  0.93146500  1
  O  O50  1  0.00141300  0.36648600  0.57801100  1
  O  O51  1  0.99475100  0.87225200  0.39452800  1
  O  O52  1  0.32454000  0.21053700  0.36819900  1
  O  O53  1  0.70004200  0.03898200  0.57442500  1
  O  O54  1  0.71815000  0.08633800  0.15769400  1
  O  O55  1  0.87225200  0.99475100  0.89452800  1
  O  O56  1  0.21053700  0.32454000  0.86819900  1
  O  O57  1  0.04607200  0.44979500  0.16321100  1
  O  O58  1  0.60243400  0.23074500  0.85203700  1
  O  O59  1  0.46443900  0.35638200  0.15176300  1
  O  O60  1  0.64145200  0.30307800  0.40573500  1
  O  O61  1  0.35638200  0.46443900  0.65176300  1
  O  O62  1  0.03898200  0.70004200  0.07442500  1
  O  O63  1  0.23074500  0.60243400  0.35203700  1
  O  O64  1  0.08633800  0.71815000  0.65769400  1
  O  O65  1  0.30307800  0.64145200  0.90573500  1
