# generated using pymatgen data_Li2Mn3(BO3)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.34822200 _cell_length_b 8.23226503 _cell_length_c 14.72675328 _cell_angle_alpha 90.00898127 _cell_angle_beta 102.34047637 _cell_angle_gamma 90.00467010 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2Mn3(BO3)3 _chemical_formula_sum 'Li8 Mn12 B12 O36' _cell_volume 751.84145109 _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 0.25332900 0.70891100 0.01064600 1.0 Li Li1 1 0.75445100 0.71075900 0.00923100 1.0 Li Li2 1 0.57293900 0.65698400 0.63932000 1.0 Li Li3 1 0.92457300 0.63038800 0.35046200 1.0 Li Li4 1 0.00751200 0.21066200 0.51060000 1.0 Li Li5 1 0.50595000 0.20790900 0.51005300 1.0 Li Li6 1 0.31932300 0.15859600 0.14048200 1.0 Li Li7 1 0.67370400 0.12957900 0.85052700 1.0 Mn Mn8 1 0.24810700 0.85790600 0.49420900 1.0 Mn Mn9 1 0.74535100 0.85767100 0.49414800 1.0 Mn Mn10 1 0.09792900 0.82807200 0.19010300 1.0 Mn Mn11 1 0.59529700 0.83049300 0.18898800 1.0 Mn Mn12 1 0.40241500 0.81341700 0.81571200 1.0 Mn Mn13 1 0.91178300 0.81475000 0.81702500 1.0 Mn Mn14 1 0.49808300 0.35649700 0.99470000 1.0 Mn Mn15 1 0.99988200 0.35831000 0.99343700 1.0 Mn Mn16 1 0.34149300 0.32986100 0.68854500 1.0 Mn Mn17 1 0.85183000 0.32891100 0.69041000 1.0 Mn Mn18 1 0.15813500 0.31378500 0.31611000 1.0 Mn Mn19 1 0.66004100 0.31320500 0.31588800 1.0 B B20 1 0.99975800 0.99610200 0.00036800 1.0 B B21 1 0.49915400 0.99382300 0.00020600 1.0 B B22 1 0.07827800 0.00412800 0.66308000 1.0 B B23 1 0.58305600 0.00104400 0.66582500 1.0 B B24 1 0.91962200 0.99707200 0.33495700 1.0 B B25 1 0.41650300 0.00624100 0.33564500 1.0 B B26 1 0.25231400 0.49546900 0.50095300 1.0 B B27 1 0.75185400 0.49463600 0.50099300 1.0 B B28 1 0.67021200 0.50052900 0.83289300 1.0 B B29 1 0.16959800 0.50110300 0.83777300 1.0 B B30 1 0.33070800 0.50431800 0.16405000 1.0 B B31 1 0.83531400 0.50224900 0.16525100 1.0 O O32 1 0.53362200 0.98760000 0.57036100 1.0 O O33 1 0.03397200 0.97848800 0.56809500 1.0 O O34 1 0.36983600 0.98640300 0.23859300 1.0 O O35 1 0.87417300 0.97518900 0.23947000 1.0 O O36 1 0.94740400 0.86040200 0.39212700 1.0 O O37 1 0.44628900 0.87492200 0.39312500 1.0 O O38 1 0.10985500 0.88023100 0.72639300 1.0 O O39 1 0.60860600 0.86231400 0.72033400 1.0 O O40 1 0.02301600 0.84478500 0.04450800 1.0 O O41 1 0.51952000 0.84234300 0.04413600 1.0 O O42 1 0.18812400 0.65912400 0.87326700 1.0 O O43 1 0.68642200 0.65522200 0.87024300 1.0 O O44 1 0.35037700 0.65966100 0.20036600 1.0 O O45 1 0.85237300 0.65838800 0.20258500 1.0 O O46 1 0.29526100 0.63473700 0.55219600 1.0 O O47 1 0.76192000 0.63414100 0.55206300 1.0 O O48 1 0.18185100 0.50168700 0.40567800 1.0 O O49 1 0.72317000 0.50078300 0.40573600 1.0 O O50 1 0.78577600 0.48094600 0.06980100 1.0 O O51 1 0.28081000 0.48527200 0.06858700 1.0 O O52 1 0.11734700 0.47742100 0.74215800 1.0 O O53 1 0.62497000 0.48039400 0.73560000 1.0 O O54 1 0.20167200 0.36880100 0.89586000 1.0 O O55 1 0.69761900 0.36402200 0.88903800 1.0 O O56 1 0.36077400 0.36683600 0.22003800 1.0 O O57 1 0.86895800 0.37476700 0.22708500 1.0 O O58 1 0.27869000 0.34369600 0.54476200 1.0 O O59 1 0.77114500 0.34274800 0.54558000 1.0 O O60 1 0.93688300 0.15210700 0.37283500 1.0 O O61 1 0.43201100 0.16470700 0.37159600 1.0 O O62 1 0.09233900 0.16457400 0.69410900 1.0 O O63 1 0.60755600 0.15341600 0.70813100 1.0 O O64 1 0.04357100 0.13589100 0.05158700 1.0 O O65 1 0.50747400 0.13314400 0.05187500 1.0 O O66 1 0.47152000 0.00151200 0.90492000 1.0 O O67 1 0.93229300 0.00405800 0.90506100 1.0