# generated using pymatgen
data_LiMnBO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.11028800
_cell_length_b   10.53791300
_cell_length_c   10.55146971
_cell_angle_alpha   87.78837529
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnBO3
_chemical_formula_sum   'Li16 Mn16 B16 O48'
_cell_volume   1012.22264391
_cell_formula_units_Z   16
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  0.73735300  0.16168700  0.54238700  1
  Li  Li1  1  0.76264700  0.66168700  0.54238700  1
  Li  Li2  1  0.23735300  0.33831300  0.45761300  1
  Li  Li3  1  0.26264700  0.83831300  0.45761300  1
  Li  Li4  1  0.25539800  0.09021100  0.29548400  1
  Li  Li5  1  0.24460200  0.59021100  0.29548400  1
  Li  Li6  1  0.73939800  0.33902000  0.20729700  1
  Li  Li7  1  0.76060200  0.83902000  0.20729700  1
  Li  Li8  1  0.75605000  0.08998900  0.04611800  1
  Li  Li9  1  0.74395000  0.58998900  0.04611800  1
  Li  Li10  1  0.25605000  0.41001100  0.95388200  1
  Li  Li11  1  0.24395000  0.91001100  0.95388200  1
  Li  Li12  1  0.23939800  0.16098000  0.79270300  1
  Li  Li13  1  0.26060200  0.66098000  0.79270300  1
  Li  Li14  1  0.75539800  0.40978900  0.70451600  1
  Li  Li15  1  0.74460200  0.90978900  0.70451600  1
  Mn  Mn16  1  0.41317500  0.11941500  0.54700400  1
  Mn  Mn17  1  0.08682500  0.61941500  0.54700400  1
  Mn  Mn18  1  0.91317500  0.38058500  0.45299600  1
  Mn  Mn19  1  0.58682500  0.88058500  0.45299600  1
  Mn  Mn20  1  0.91699600  0.12235600  0.29609300  1
  Mn  Mn21  1  0.58300400  0.62235600  0.29609300  1
  Mn  Mn22  1  0.41261600  0.37271700  0.20892800  1
  Mn  Mn23  1  0.08738400  0.87271700  0.20892800  1
  Mn  Mn24  1  0.41596200  0.13019200  0.03992000  1
  Mn  Mn25  1  0.08403800  0.63019200  0.03992000  1
  Mn  Mn26  1  0.91596200  0.36980800  0.96008000  1
  Mn  Mn27  1  0.58403800  0.86980800  0.96008000  1
  Mn  Mn28  1  0.91261600  0.12728300  0.79107200  1
  Mn  Mn29  1  0.58738400  0.62728300  0.79107200  1
  Mn  Mn30  1  0.41699600  0.37764400  0.70390700  1
  Mn  Mn31  1  0.08300400  0.87764400  0.70390700  1
  B  B32  1  0.08016600  0.13014500  0.54189300  1
  B  B33  1  0.41983400  0.63014500  0.54189300  1
  B  B34  1  0.58016600  0.36985500  0.45810700  1
  B  B35  1  0.91983400  0.86985500  0.45810700  1
  B  B36  1  0.58074200  0.13113600  0.29153400  1
  B  B37  1  0.91925800  0.63113600  0.29153400  1
  B  B38  1  0.08096700  0.38079800  0.20876200  1
  B  B39  1  0.41903300  0.88079800  0.20876200  1
  B  B40  1  0.08156000  0.11980900  0.04111600  1
  B  B41  1  0.41844000  0.61980900  0.04111600  1
  B  B42  1  0.58156000  0.38019100  0.95888400  1
  B  B43  1  0.91844000  0.88019100  0.95888400  1
  B  B44  1  0.58096700  0.11920200  0.79123800  1
  B  B45  1  0.91903300  0.61920200  0.79123800  1
  B  B46  1  0.08074200  0.36886400  0.70846600  1
  B  B47  1  0.41925800  0.86886400  0.70846600  1
  O  O48  1  0.08983300  0.40958100  0.58077800  1
  O  O49  1  0.41016700  0.90958100  0.58077800  1
  O  O50  1  0.70501800  0.35576300  0.53232100  1
  O  O51  1  0.79498200  0.85576300  0.53232100  1
  O  O52  1  0.44276100  0.33995100  0.50965800  1
  O  O53  1  0.05723900  0.83995100  0.50965800  1
  O  O54  1  0.94276100  0.16004900  0.49034200  1
  O  O55  1  0.55723900  0.66004900  0.49034200  1
  O  O56  1  0.20501800  0.14423700  0.46767900  1
  O  O57  1  0.29498200  0.64423700  0.46767900  1
  O  O58  1  0.58983300  0.09041900  0.41922200  1
  O  O59  1  0.91016700  0.59041900  0.41922200  1
  O  O60  1  0.59222700  0.40991300  0.33014400  1
  O  O61  1  0.90777300  0.90991300  0.33014400  1
  O  O62  1  0.20270200  0.39457900  0.28584800  1
  O  O63  1  0.29729800  0.89457900  0.28584800  1
  O  O64  1  0.94660000  0.34032500  0.26027500  1
  O  O65  1  0.55340000  0.84032500  0.26027500  1
  O  O66  1  0.44360200  0.16127200  0.23789600  1
  O  O67  1  0.70660700  0.14538400  0.21876100  1
  O  O68  1  0.05639800  0.66127200  0.23789600  1
  O  O69  1  0.79339300  0.64538400  0.21876100  1
  O  O70  1  0.08999100  0.08793100  0.17057500  1
  O  O71  1  0.41000900  0.58793100  0.17057500  1
  O  O72  1  0.09206400  0.41151100  0.07891900  1
  O  O73  1  0.40793600  0.91151100  0.07891900  1
  O  O74  1  0.70446300  0.39264300  0.03478100  1
  O  O75  1  0.79553700  0.89264300  0.03478100  1
  O  O76  1  0.44706600  0.34026800  0.01217600  1
  O  O77  1  0.05293400  0.84026800  0.01217600  1
  O  O78  1  0.94706600  0.15973200  0.98782400  1
  O  O79  1  0.55293400  0.65973200  0.98782400  1
  O  O80  1  0.20446300  0.10735700  0.96521900  1
  O  O81  1  0.29553700  0.60735700  0.96521900  1
  O  O82  1  0.59206400  0.08848900  0.92108100  1
  O  O83  1  0.90793600  0.58848900  0.92108100  1
  O  O84  1  0.58999100  0.41206900  0.82942500  1
  O  O85  1  0.91000900  0.91206900  0.82942500  1
  O  O86  1  0.20660700  0.35461600  0.78123900  1
  O  O87  1  0.94360200  0.33872800  0.76210400  1
  O  O88  1  0.29339300  0.85461600  0.78123900  1
  O  O89  1  0.55639800  0.83872800  0.76210400  1
  O  O90  1  0.44660000  0.15967500  0.73972500  1
  O  O91  1  0.05340000  0.65967500  0.73972500  1
  O  O92  1  0.70270200  0.10542100  0.71415200  1
  O  O93  1  0.79729800  0.60542100  0.71415200  1
  O  O94  1  0.09222700  0.09008700  0.66985600  1
  O  O95  1  0.40777300  0.59008700  0.66985600  1
