# generated using pymatgen
data_LiMn2(BO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.25285507
_cell_length_b   13.93360167
_cell_length_c   11.59501522
_cell_angle_alpha   66.23360605
_cell_angle_beta   77.71884092
_cell_angle_gamma   90.88920090
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn2(BO3)2
_chemical_formula_sum   'Li6 Mn12 B12 O36'
_cell_volume   754.03063581
_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  0.22684600  0.62334700  0.23003900  1
  Li  Li1  1  0.25637200  0.89614400  0.76564200  1
  Li  Li2  1  0.42950800  0.70651800  0.43660000  1
  Li  Li3  1  0.41165000  0.43081600  0.89407400  1
  Li  Li4  1  0.59025900  0.28408500  0.54248100  1
  Li  Li5  1  0.75467500  0.10825900  0.22914200  1
  Mn  Mn6  1  0.00977700  0.82620100  0.29980600  1
  Mn  Mn7  1  0.07227800  0.43726700  0.18462500  1
  Mn  Mn8  1  0.33784500  0.84518000  0.02356400  1
  Mn  Mn9  1  0.29516000  0.24512100  0.12831600  1
  Mn  Mn10  1  0.34430200  0.47578200  0.63855500  1
  Mn  Mn11  1  0.39670900  0.09493300  0.52029300  1
  Mn  Mn12  1  0.59570500  0.89186500  0.48001600  1
  Mn  Mn13  1  0.66791400  0.51718000  0.35482500  1
  Mn  Mn14  1  0.73608300  0.76040400  0.85641000  1
  Mn  Mn15  1  0.67589500  0.14160500  0.97723200  1
  Mn  Mn16  1  0.95395100  0.57158800  0.79132100  1
  Mn  Mn17  1  0.99505900  0.16735800  0.69776100  1
  B  B18  1  0.10335500  0.39910000  0.47941600  1
  B  B19  1  0.15742400  0.02442900  0.35443300  1
  B  B20  1  0.18293900  0.66480900  0.96502400  1
  B  B21  1  0.55984000  0.92344700  0.20206900  1
  B  B22  1  0.23380400  0.25101400  0.87160300  1
  B  B23  1  0.51214200  0.32391500  0.29900300  1
  B  B24  1  0.48474400  0.65955300  0.69631200  1
  B  B25  1  0.76096500  0.73740400  0.13534300  1
  B  B26  1  0.43577500  0.07256700  0.78842300  1
  B  B27  1  0.84006200  0.34827700  0.01819000  1
  B  B28  1  0.82906100  0.98421000  0.64233100  1
  B  B29  1  0.89527100  0.59964000  0.52541900  1
  O  O30  1  0.00621100  0.75859800  0.15515200  1
  O  O31  1  0.08407000  0.36421500  0.04397500  1
  O  O32  1  0.01239000  0.92779400  0.40035900  1
  O  O33  1  0.06116200  0.47563100  0.36502600  1
  O  O34  1  0.08718300  0.11408300  0.26940700  1
  O  O35  1  0.06873900  0.67995500  0.43291800  1
  O  O36  1  0.21355800  0.59155600  0.07751200  1
  O  O37  1  0.35632900  0.89635700  0.15448500  1
  O  O38  1  0.04539600  0.19922900  0.84304800  1
  O  O39  1  0.31975700  0.31983600  0.23431400  1
  O  O40  1  0.34774000  0.41509200  0.51193500  1
  O  O41  1  0.39180000  0.03027400  0.39871700  1
  O  O42  1  0.30093900  0.97779500  0.86366100  1
  O  O43  1  0.43032400  0.73882800  0.59554000  1
  O  O44  1  0.34156600  0.55518600  0.75080200  1
  O  O45  1  0.58332200  0.65811800  0.23000200  1
  O  O46  1  0.70437300  0.80089100  0.01680500  1
  O  O47  1  0.31467900  0.76952000  0.91086500  1
  O  O48  1  0.37691700  0.14099300  0.66651900  1
  O  O49  1  0.60299100  0.84787500  0.31774700  1
  O  O50  1  0.35217200  0.34983100  0.79332000  1
  O  O51  1  0.29666100  0.19590900  0.99165200  1
  O  O52  1  0.70021900  0.24611800  0.08454300  1
  O  O53  1  0.54071800  0.23915400  0.40603500  1
  O  O54  1  0.66657000  0.41770700  0.25741000  1
  O  O55  1  0.69529100  0.02028400  0.14350400  1
  O  O56  1  0.58647500  0.97089300  0.61180600  1
  O  O57  1  0.64839800  0.57768200  0.50531300  1
  O  O58  1  0.67482800  0.66577800  0.75956700  1
  O  O59  1  0.64320500  0.11463200  0.81498500  1
  O  O60  1  0.74640800  0.42960400  0.93241400  1
  O  O61  1  0.93605200  0.31148900  0.55935300  1
  O  O62  1  0.93355300  0.89964300  0.71458500  1
  O  O63  1  0.95692500  0.53240200  0.64279700  1
  O  O64  1  0.96214000  0.08690200  0.59204300  1
  O  O65  1  0.01868100  0.65183900  0.89104300  1
