# generated using pymatgen
data_LiMnBO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.48769700
_cell_length_b   5.54900000
_cell_length_c   9.52000700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnBO4
_chemical_formula_sum   'Li4 Mn4 B4 O16'
_cell_volume   237.06941013
_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  0.00000000  0.50000000  0.50000000  1
  Li  Li1  1  0.50000000  0.50000000  0.00000000  1
  Li  Li2  1  0.00000000  0.00000000  0.50000000  1
  Li  Li3  1  0.50000000  0.00000000  0.00000000  1
  Mn  Mn4  1  0.98494100  0.75000000  0.22853000  1
  Mn  Mn5  1  0.51505900  0.75000000  0.72853000  1
  Mn  Mn6  1  0.48494100  0.25000000  0.27147000  1
  Mn  Mn7  1  0.01505900  0.25000000  0.77147000  1
  B  B8  1  0.43548900  0.75000000  0.40869400  1
  B  B9  1  0.06451100  0.75000000  0.90869400  1
  B  B10  1  0.93548900  0.25000000  0.09130600  1
  B  B11  1  0.56451100  0.25000000  0.59130600  1
  O  O12  1  0.27131100  0.54107900  0.33134000  1
  O  O13  1  0.22868900  0.54107900  0.83134000  1
  O  O14  1  0.18021400  0.75000000  0.05098400  1
  O  O15  1  0.75000300  0.75000000  0.39658000  1
  O  O16  1  0.31978600  0.75000000  0.55098400  1
  O  O17  1  0.74999700  0.75000000  0.89658000  1
  O  O18  1  0.27131100  0.95892100  0.33134000  1
  O  O19  1  0.22868900  0.95892100  0.83134000  1
  O  O20  1  0.72868900  0.04107900  0.66866000  1
  O  O21  1  0.77131100  0.04107900  0.16866000  1
  O  O22  1  0.81978600  0.25000000  0.94901600  1
  O  O23  1  0.68021400  0.25000000  0.44901600  1
  O  O24  1  0.25000300  0.25000000  0.10342000  1
  O  O25  1  0.24999700  0.25000000  0.60342000  1
  O  O26  1  0.77131100  0.45892100  0.16866000  1
  O  O27  1  0.72868900  0.45892100  0.66866000  1
