# generated using pymatgen
data_Li4MnO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.09826200
_cell_length_b   5.83226803
_cell_length_c   12.97168779
_cell_angle_alpha   96.31352299
_cell_angle_beta   101.22538101
_cell_angle_gamma   63.93458720
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnO3
_chemical_formula_sum   'Li16 Mn4 O12'
_cell_volume   339.71765082
_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  0.97272700  0.22199800  0.46111700  1
  Li  Li1  1  0.97264100  0.72203200  0.96110600  1
  Li  Li2  1  0.26551200  0.97139600  0.21093000  1
  Li  Li3  1  0.26548100  0.47139100  0.71089200  1
  Li  Li4  1  0.88296000  0.87079700  0.32028200  1
  Li  Li5  1  0.88296200  0.37074300  0.82026600  1
  Li  Li6  1  0.56484200  0.62132700  0.06994900  1
  Li  Li7  1  0.56481300  0.12129700  0.56995600  1
  Li  Li8  1  0.51186400  0.82609600  0.41539500  1
  Li  Li9  1  0.51181000  0.32604600  0.91537800  1
  Li  Li10  1  0.07544300  0.57706900  0.16474900  1
  Li  Li11  1  0.07541600  0.07708300  0.66471000  1
  Li  Li12  1  0.71265300  0.54029200  0.26670700  1
  Li  Li13  1  0.71256900  0.04029900  0.76667300  1
  Li  Li14  1  0.01414700  0.28915800  0.01627400  1
  Li  Li15  1  0.01412700  0.78921300  0.51628000  1
  Mn  Mn16  1  0.33356000  0.90023600  0.86854100  1
  Mn  Mn17  1  0.63273600  0.15393900  0.12238600  1
  Mn  Mn18  1  0.33361900  0.40014000  0.36873600  1
  Mn  Mn19  1  0.63291700  0.65392100  0.62232600  1
  O  O20  1  0.67374400  0.09497100  0.42947200  1
  O  O21  1  0.67379800  0.59484900  0.92943100  1
  O  O22  1  0.66063400  0.84393100  0.17944300  1
  O  O23  1  0.66055200  0.34389300  0.67938400  1
  O  O24  1  0.29358500  0.69802000  0.29109700  1
  O  O25  1  0.29350200  0.19791300  0.79102800  1
  O  O26  1  0.29957800  0.44694900  0.04129700  1
  O  O27  1  0.29968200  0.94682100  0.54129500  1
  O  O28  1  0.93039300  0.53983100  0.41443900  1
  O  O29  1  0.93025100  0.03989200  0.91436100  1
  O  O30  1  0.94431800  0.29010900  0.16477700  1
  O  O31  1  0.94428600  0.79013200  0.66472800  1
