# generated using pymatgen
data_Li4Mn3Fe(BO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23594200
_cell_length_b   5.24916065
_cell_length_c   10.49638357
_cell_angle_alpha   91.01177163
_cell_angle_beta   90.77855432
_cell_angle_gamma   119.78245247
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Mn3Fe(BO3)4
_chemical_formula_sum   'Li4 Mn3 Fe1 B4 O12'
_cell_volume   250.25972869
_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  0.34784900  0.32133500  0.33189300  1
  Li  Li1  1  0.32137600  0.34882000  0.83181200  1
  Li  Li2  1  0.66196100  0.65339900  0.58305300  1
  Li  Li3  1  0.65115600  0.66214900  0.08288500  1
  Mn  Mn4  1  0.99353600  0.32620200  0.11790400  1
  Mn  Mn5  1  0.99790000  0.67663300  0.86716500  1
  Mn  Mn6  1  0.33052300  0.99596200  0.61495600  1
  Fe  Fe7  1  0.68280200  0.99573900  0.36762200  1
  B  B8  1  0.65850600  0.00268600  0.87412800  1
  B  B9  1  0.99682400  0.33492100  0.62303500  1
  B  B10  1  0.00309400  0.66128400  0.37377300  1
  B  B11  1  0.33376600  0.99414600  0.12582200  1
  O  O12  1  0.75431700  0.07111600  0.58047900  1
  O  O13  1  0.92946900  0.25307800  0.90442400  1
  O  O14  1  0.42098100  0.03305700  0.83237000  1
  O  O15  1  0.96297300  0.57761200  0.65361700  1
  O  O16  1  0.35791100  0.26774200  0.13972300  1
  O  O17  1  0.26995000  0.35829100  0.63814200  1
  O  O18  1  0.72852200  0.64033300  0.38755200  1
  O  O19  1  0.62914500  0.72829800  0.88885100  1
  O  O20  1  0.02112400  0.41494100  0.33588600  1
  O  O21  1  0.57760000  0.96176200  0.15686900  1
  O  O22  1  0.07071100  0.75165700  0.08297300  1
  O  O23  1  0.25740300  0.92823500  0.40126200  1
