# generated using pymatgen
data_LiMnBO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.44040800
_cell_length_b   8.29867826
_cell_length_c   8.29197346
_cell_angle_alpha   59.98768628
_cell_angle_beta   90.00060041
_cell_angle_gamma   90.00049840
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMnBO3
_chemical_formula_sum   'Li6 Mn6 B6 O18'
_cell_volume   383.75755828
_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  0.99998500  0.37559900  0.96888300  1
  Li  Li1  1  0.50002300  0.37559400  0.96888800  1
  Li  Li2  1  0.00003100  0.65588400  0.37546200  1
  Li  Li3  1  0.49996800  0.65588200  0.37547300  1
  Li  Li4  1  0.00000600  0.96879700  0.65580100  1
  Li  Li5  1  0.49999800  0.96879700  0.65580400  1
  Mn  Mn6  1  0.74998400  0.29037700  0.67158300  1
  Mn  Mn7  1  0.75002400  0.03851200  0.29026600  1
  Mn  Mn8  1  0.24998100  0.67098400  0.03884100  1
  Mn  Mn9  1  0.25000600  0.29033700  0.67165700  1
  Mn  Mn10  1  0.24999300  0.03848900  0.29020500  1
  Mn  Mn11  1  0.74996700  0.67093900  0.03898100  1
  B  B12  1  0.25000300  0.33325500  0.33325800  1
  B  B13  1  0.75000200  0.33323200  0.33327800  1
  B  B14  1  0.99998600  0.99997200  0.99989600  1
  B  B15  1  0.50000000  0.99997400  0.99990800  1
  B  B16  1  0.25000900  0.66668500  0.66660900  1
  B  B17  1  0.75000800  0.66666500  0.66664500  1
  O  O18  1  0.99998500  0.10358200  0.80668900  1
  O  O19  1  0.50000900  0.10356400  0.80670500  1
  O  O20  1  0.99998400  0.08954300  0.10354400  1
  O  O21  1  0.50002500  0.08954000  0.10356000  1
  O  O22  1  0.00000900  0.80683300  0.08958700  1
  O  O23  1  0.49995300  0.80683100  0.08959200  1
  O  O24  1  0.25000100  0.14775000  0.47261000  1
  O  O25  1  0.74999500  0.14776500  0.47270500  1
  O  O26  1  0.25000100  0.47260600  0.37952300  1
  O  O27  1  0.75000900  0.47265900  0.37944700  1
  O  O28  1  0.25000200  0.37983200  0.14737600  1
  O  O29  1  0.75000300  0.37973000  0.14742300  1
  O  O30  1  0.25000900  0.47283400  0.77015600  1
  O  O31  1  0.75000500  0.47281600  0.77014100  1
  O  O32  1  0.25001300  0.77012700  0.75706200  1
  O  O33  1  0.75000800  0.77004900  0.75717000  1
  O  O34  1  0.25000600  0.75697100  0.47262200  1
  O  O35  1  0.75001100  0.75698800  0.47265700  1
