# generated using pymatgen
data_LiMn2(BO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.35171900
_cell_length_b   10.20806866
_cell_length_c   13.95870797
_cell_angle_alpha   90.41237040
_cell_angle_beta   100.42435574
_cell_angle_gamma   91.90733808
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn2(BO3)2
_chemical_formula_sum   'Li6 Mn12 B12 O36'
_cell_volume   749.50432864
_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  0.15167500  0.14619000  0.99388500  1
  Li  Li1  1  0.46841400  0.66494500  0.67329400  1
  Li  Li2  1  0.47807100  0.16911800  0.65537100  1
  Li  Li3  1  0.81307100  0.67056300  0.34110100  1
  Li  Li4  1  0.80208800  0.16020600  0.32232000  1
  Li  Li5  1  0.87035900  0.41427100  0.00925500  1
  Mn  Mn6  1  0.27935800  0.87759400  0.88269700  1
  Mn  Mn7  1  0.60837700  0.63353300  0.90421000  1
  Mn  Mn8  1  0.04726000  0.13086600  0.76904700  1
  Mn  Mn9  1  0.73253600  0.38038300  0.78144400  1
  Mn  Mn10  1  0.62668200  0.88177300  0.56083300  1
  Mn  Mn11  1  0.06743600  0.38146500  0.43743300  1
  Mn  Mn12  1  0.92096400  0.62947400  0.54997700  1
  Mn  Mn13  1  0.37359600  0.12704300  0.44665100  1
  Mn  Mn14  1  0.26190000  0.63500900  0.21727200  1
  Mn  Mn15  1  0.95703700  0.87954600  0.21807100  1
  Mn  Mn16  1  0.40897500  0.37544000  0.11952000  1
  Mn  Mn17  1  0.70894500  0.11960900  0.10151200  1
  B  B18  1  0.27653000  0.37358300  0.89152500  1
  B  B19  1  0.04508600  0.62993900  0.77477300  1
  B  B20  1  0.60719900  0.13284700  0.88196100  1
  B  B21  1  0.72298200  0.87177100  0.78971100  1
  B  B22  1  0.06734200  0.87186200  0.44897900  1
  B  B23  1  0.61518700  0.37337300  0.55089300  1
  B  B24  1  0.38484100  0.63308100  0.44379200  1
  B  B25  1  0.94288100  0.12970700  0.54795400  1
  B  B26  1  0.27427800  0.12086400  0.22186000  1
  B  B27  1  0.39343600  0.87353100  0.11112500  1
  B  B28  1  0.94153400  0.37374300  0.21347400  1
  B  B29  1  0.73812100  0.62581800  0.12144500  1
  O  O30  1  0.20072500  0.35906900  0.97926000  1
  O  O31  1  0.19881000  0.68577700  0.85813100  1
  O  O32  1  0.36155900  0.07680100  0.87993000  1
  O  O33  1  0.78381500  0.14036400  0.96356600  1
  O  O34  1  0.52402500  0.42286600  0.88701900  1
  O  O35  1  0.11167200  0.33657400  0.80594400  1
  O  O36  1  0.63395500  0.83455700  0.87470600  1
  O  O37  1  0.12042300  0.62927100  0.68741900  1
  O  O38  1  0.65879400  0.18494800  0.79271500  1
  O  O39  1  0.80389600  0.57361300  0.78603900  1
  O  O40  1  0.12015300  0.13046400  0.63004300  1
  O  O41  1  0.58448000  0.84703200  0.70029400  1
  O  O42  1  0.96121100  0.93479500  0.80223000  1
  O  O43  1  0.56743800  0.35587800  0.64159900  1
  O  O44  1  0.00390100  0.16536900  0.45776100  1
  O  O45  1  0.53894800  0.66845600  0.53424600  1
  O  O46  1  0.68822300  0.09097200  0.55015600  1
  O  O47  1  0.13134600  0.59133900  0.44532700  1
  O  O48  1  0.82732200  0.44399700  0.53121100  1
  O  O49  1  0.30067400  0.94175100  0.46708700  1
  O  O50  1  0.44876100  0.31739500  0.46964000  1
  O  O51  1  0.98382100  0.81822100  0.53169100  1
  O  O52  1  0.47177000  0.63693700  0.35917200  1
  O  O53  1  0.01992600  0.07121400  0.21802200  1
  O  O54  1  0.44056200  0.12547600  0.30735100  1
  O  O55  1  0.92819100  0.85454900  0.35955500  1
  O  O56  1  0.15951200  0.44866800  0.20362400  1
  O  O57  1  0.31157500  0.82449800  0.19637100  1
  O  O58  1  0.88189800  0.34372700  0.30023100  1
  O  O59  1  0.33784600  0.16538700  0.13462000  1
  O  O60  1  0.89152800  0.68388900  0.20709600  1
  O  O61  1  0.50028100  0.58130800  0.13375800  1
  O  O62  1  0.23816000  0.88503600  0.02574700  1
  O  O63  1  0.64691400  0.91893600  0.12528500  1
  O  O64  1  0.79084500  0.32753400  0.12627000  1
  O  O65  1  0.82578800  0.60604900  0.03857200  1
