# generated using pymatgen
data_Li2Mn3(BO3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.71407800
_cell_length_b   8.26885100
_cell_length_c   8.28046824
_cell_angle_alpha   60.19065508
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Mn3(BO3)3
_chemical_formula_sum   'Li8 Mn12 B12 O36'
_cell_volume   755.34736031
_cell_formula_units_Z   4
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  0.50000000  0.70301300  0.27798700  1
  Li  Li1  1  0.00000000  0.69994600  0.27720100  1
  Li  Li2  1  0.50000000  0.27928200  0.02186200  1
  Li  Li3  1  0.74844900  0.27978500  0.01821900  1
  Li  Li4  1  0.25155100  0.27978500  0.01821900  1
  Li  Li5  1  0.75121100  0.02161700  0.70026700  1
  Li  Li6  1  0.00000000  0.01705000  0.70101500  1
  Li  Li7  1  0.24878900  0.02161700  0.70026700  1
  Mn  Mn8  1  0.37515300  0.98083800  0.38267800  1
  Mn  Mn9  1  0.62484700  0.98083800  0.38267800  1
  Mn  Mn10  1  0.87446800  0.98873300  0.36022900  1
  Mn  Mn11  1  0.12553200  0.98873300  0.36022900  1
  Mn  Mn12  1  0.37443900  0.37061300  0.63145200  1
  Mn  Mn13  1  0.62556100  0.37061300  0.63145200  1
  Mn  Mn14  1  0.87464000  0.37945700  0.63910300  1
  Mn  Mn15  1  0.12536000  0.37945700  0.63910300  1
  Mn  Mn16  1  0.87517100  0.63046400  0.99673100  1
  Mn  Mn17  1  0.37595600  0.64973200  0.98992200  1
  Mn  Mn18  1  0.62404400  0.64973200  0.98992200  1
  Mn  Mn19  1  0.12482900  0.63046400  0.99673100  1
  B  B20  1  0.87461900  0.00057700  0.99168600  1
  B  B21  1  0.37402500  0.00623800  0.00246400  1
  B  B22  1  0.62597500  0.00623800  0.00246400  1
  B  B23  1  0.12538100  0.00057700  0.99168600  1
  B  B24  1  0.25007900  0.32740900  0.33768800  1
  B  B25  1  0.00000000  0.33481400  0.33672000  1
  B  B26  1  0.74992100  0.32740900  0.33768800  1
  B  B27  1  0.50000000  0.33229100  0.32440000  1
  B  B28  1  0.75026400  0.66939000  0.67355400  1
  B  B29  1  0.50000000  0.65772300  0.66887000  1
  B  B30  1  0.00000000  0.66956300  0.66032500  1
  B  B31  1  0.24973600  0.66939000  0.67355400  1
  O  O32  1  0.61561100  0.81602800  0.10245800  1
  O  O33  1  0.11459700  0.80958400  0.09354600  1
  O  O34  1  0.38438900  0.81602800  0.10245800  1
  O  O35  1  0.88540300  0.80958400  0.09354600  1
  O  O36  1  0.50000000  0.77654000  0.47387400  1
  O  O37  1  0.00000000  0.78471300  0.46687100  1
  O  O38  1  0.74440400  0.78498100  0.48391700  1
  O  O39  1  0.25559600  0.78498100  0.48391700  1
  O  O40  1  0.50000000  0.44953100  0.13375700  1
  O  O41  1  0.25079100  0.44137100  0.14670700  1
  O  O42  1  0.74920900  0.44137100  0.14670700  1
  O  O43  1  0.00000000  0.45902000  0.14703700  1
  O  O44  1  0.86136600  0.10056400  0.08174200  1
  O  O45  1  0.37763000  0.11176000  0.09191800  1
  O  O46  1  0.62237000  0.11176000  0.09191800  1
  O  O47  1  0.13863400  0.10056400  0.08174200  1
  O  O48  1  0.24678400  0.39507800  0.46013700  1
  O  O49  1  0.00000000  0.41178000  0.45300800  1
  O  O50  1  0.75321600  0.39507800  0.46013700  1
  O  O51  1  0.50000000  0.40940500  0.43943400  1
  O  O52  1  0.50000000  0.73148600  0.78318200  1
  O  O53  1  0.75377700  0.74516000  0.79171700  1
  O  O54  1  0.24622300  0.74516000  0.79171700  1
  O  O55  1  0.00000000  0.74407000  0.77735700  1
  O  O56  1  0.50000000  0.46431100  0.74054000  1
  O  O57  1  0.75267800  0.47694700  0.74853700  1
  O  O58  1  0.00000000  0.47788300  0.73369300  1
  O  O59  1  0.24732200  0.47694700  0.74853700  1
  O  O60  1  0.50000000  0.14096300  0.39289900  1
  O  O61  1  0.00000000  0.14454900  0.41023600  1
  O  O62  1  0.25255100  0.13431700  0.41386400  1
  O  O63  1  0.74744900  0.13431700  0.41386400  1
  O  O64  1  0.35990400  0.09543900  0.81208400  1
  O  O65  1  0.64009600  0.09543900  0.81208400  1
  O  O66  1  0.87727300  0.08989200  0.79746800  1
  O  O67  1  0.12272700  0.08989200  0.79746800  1
