# generated using pymatgen
data_Li8Mn7Fe(BO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.26278900
_cell_length_b   9.11645429
_cell_length_c   11.62481496
_cell_angle_alpha   111.56689058
_cell_angle_beta   102.23244802
_cell_angle_gamma   89.79163078
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li8Mn7Fe(BO3)8
_chemical_formula_sum   'Li8 Mn7 Fe1 B8 O24'
_cell_volume   505.21702168
_cell_formula_units_Z   1
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  0.03112300  0.03896800  0.41672300  1
  Li  Li1  1  0.29513500  0.28449500  0.91714200  1
  Li  Li2  1  0.48145500  0.50762100  0.66738300  1
  Li  Li3  1  0.27244800  0.24449800  0.16799900  1
  Li  Li4  1  0.52959200  0.54072900  0.41786500  1
  Li  Li5  1  0.79526100  0.78434600  0.91794300  1
  Li  Li6  1  0.98085100  0.00891500  0.66883800  1
  Li  Li7  1  0.77182200  0.74457800  0.16836300  1
  Mn  Mn8  1  0.02339700  0.35654100  0.38306100  1
  Mn  Mn9  1  0.27274600  0.94036700  0.88364000  1
  Mn  Mn10  1  0.24465300  0.56530900  0.13320400  1
  Mn  Mn11  1  0.52375800  0.85850600  0.38623300  1
  Mn  Mn12  1  0.77058300  0.43721200  0.88198500  1
  Mn  Mn13  1  0.74469100  0.06513800  0.13324000  1
  Mn  Mn14  1  0.97536700  0.65577700  0.63345000  1
  Fe  Fe15  1  0.47138900  0.15731700  0.63269700  1
  B  B16  1  0.02409500  0.68604700  0.37597700  1
  B  B17  1  0.26517500  0.60439100  0.87504900  1
  B  B18  1  0.23655300  0.89203400  0.12582500  1
  B  B19  1  0.47020300  0.81659800  0.62679300  1
  B  B20  1  0.52472200  0.18679700  0.37679500  1
  B  B21  1  0.76484200  0.10424600  0.87454400  1
  B  B22  1  0.73627900  0.39193300  0.12564500  1
  B  B23  1  0.97338400  0.31146200  0.62494300  1
  O  O24  1  0.01908400  0.10930400  0.86065500  1
  O  O25  1  0.09743200  0.71164600  0.84512300  1
  O  O26  1  0.17381000  0.49396900  0.91700500  1
  O  O27  1  0.08184900  0.16949300  0.61219500  1
  O  O28  1  0.09960000  0.42486100  0.59657900  1
  O  O29  1  0.23715400  0.84970200  0.66707600  1
  O  O30  1  0.26866900  0.65536700  0.34563900  1
  O  O31  1  0.51929900  0.60790300  0.85999800  1
  O  O32  1  0.59576100  0.21023000  0.84366300  1
  O  O33  1  0.40405900  0.08682300  0.41903600  1
  O  O34  1  0.40447900  0.31536600  0.36116700  1
  O  O35  1  0.67587400  0.99412100  0.91763400  1
  O  O36  1  0.33715800  0.01247800  0.09593200  1
  O  O37  1  0.57194500  0.67150500  0.61094300  1
  O  O38  1  0.59910000  0.92891900  0.59849200  1
  O  O39  1  0.40495700  0.79396000  0.16707500  1
  O  O40  1  0.46885600  0.37016200  0.11058500  1
  O  O41  1  0.73759700  0.34145700  0.66346600  1
  O  O42  1  0.76955900  0.15521100  0.34661000  1
  O  O43  1  0.90386700  0.58534900  0.41808800  1
  O  O44  1  0.90274100  0.81475500  0.36134400  1
  O  O45  1  0.83692800  0.51223600  0.09568200  1
  O  O46  1  0.90487900  0.29394900  0.16713600  1
  O  O47  1  0.96901800  0.87060800  0.11114000  1
