# generated using pymatgen
data_LiMn8F33
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.61913983
_cell_length_b   8.61913983
_cell_length_c   18.40142600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999868
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiMn8F33
_chemical_formula_sum   'Li2 Mn16 F66'
_cell_volume   1183.88623105
_cell_formula_units_Z   2
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  0.33333300  0.66666700  0.06634500  1
  Li  Li1  1  0.66666700  0.33333300  0.56634500  1
  Mn  Mn2  1  0.00715800  0.66946400  0.25131100  1
  Mn  Mn3  1  0.00737600  0.33901300  0.87572300  1
  Mn  Mn4  1  0.33163700  0.99262400  0.87572300  1
  Mn  Mn5  1  0.00000000  0.00000000  0.99608100  1
  Mn  Mn6  1  0.00000000  0.00000000  0.49608100  1
  Mn  Mn7  1  0.33333300  0.66666700  0.63028300  1
  Mn  Mn8  1  0.33053600  0.33769400  0.25131100  1
  Mn  Mn9  1  0.33769400  0.33053600  0.75131100  1
  Mn  Mn10  1  0.66230600  0.99284200  0.25131100  1
  Mn  Mn11  1  0.66098700  0.66836300  0.87572300  1
  Mn  Mn12  1  0.66836300  0.66098700  0.37572300  1
  Mn  Mn13  1  0.33901300  0.00737600  0.37572300  1
  Mn  Mn14  1  0.66666700  0.33333300  0.13028300  1
  Mn  Mn15  1  0.99284200  0.66230600  0.75131100  1
  Mn  Mn16  1  0.66946400  0.00715800  0.75131100  1
  Mn  Mn17  1  0.99262400  0.33163700  0.37572300  1
  F  F18  1  0.06801300  0.86906500  0.04438000  1
  F  F19  1  0.07480700  0.85803500  0.19714100  1
  F  F20  1  0.12649500  0.92265100  0.42775300  1
  F  F21  1  0.12693900  0.87295600  0.81126400  1
  F  F22  1  0.20507300  0.79143800  0.31467500  1
  F  F23  1  0.08365100  0.54048000  0.81464700  1
  F  F24  1  0.12392200  0.59039600  0.19820400  1
  F  F25  1  0.20406200  0.74229400  0.69831000  1
  F  F26  1  0.25086900  0.79818400  0.92959300  1
  F  F27  1  0.11410800  0.52119500  0.42956300  1
  F  F28  1  0.13439000  0.53559200  0.58194300  1
  F  F29  1  0.40708700  0.88589200  0.42956300  1
  F  F30  1  0.07734900  0.20384400  0.42775300  1
  F  F31  1  0.40120100  0.86561000  0.58194300  1
  F  F32  1  0.20181600  0.45268600  0.92959300  1
  F  F33  1  0.12704400  0.25398300  0.81126400  1
  F  F34  1  0.45682900  0.91634900  0.81464700  1
  F  F35  1  0.20856200  0.41363600  0.31467500  1
  F  F36  1  0.46647400  0.87607800  0.19820400  1
  F  F37  1  0.13093500  0.19894800  0.04438000  1
  F  F38  1  0.14196500  0.21677200  0.19714100  1
  F  F39  1  0.25770600  0.46176800  0.69831000  1
  F  F40  1  0.53823200  0.79593800  0.69831000  1
  F  F41  1  0.19894800  0.13093500  0.54438000  1
  F  F42  1  0.21677200  0.14196500  0.69714100  1
  F  F43  1  0.40960400  0.53352600  0.19820400  1
  F  F44  1  0.20384400  0.07734900  0.92775300  1
  F  F45  1  0.46440800  0.59879900  0.58194300  1
  F  F46  1  0.54731400  0.74913100  0.92959300  1
  F  F47  1  0.47880500  0.59291300  0.42956300  1
  F  F48  1  0.45952000  0.54317100  0.81464700  1
  F  F49  1  0.58636400  0.79492700  0.31467500  1
  F  F50  1  0.25398300  0.12704400  0.31126400  1
  F  F51  1  0.41363600  0.20856200  0.81467500  1
  F  F52  1  0.74601700  0.87306100  0.81126400  1
  F  F53  1  0.54317100  0.45952000  0.31464700  1
  F  F54  1  0.78322800  0.92519300  0.19714100  1
  F  F55  1  0.53352600  0.40960400  0.69820400  1
  F  F56  1  0.80105200  0.93198700  0.04438000  1
  F  F57  1  0.46176800  0.25770600  0.19831000  1
  F  F58  1  0.45268600  0.20181600  0.42959300  1
  F  F59  1  0.59291300  0.47880500  0.92956300  1
  F  F60  1  0.59879900  0.46440800  0.08194300  1
  F  F61  1  0.79615600  0.87350500  0.42775300  1
  F  F62  1  0.52119500  0.11410800  0.92956300  1
  F  F63  1  0.87350500  0.79615600  0.92775300  1
  F  F64  1  0.53559200  0.13439000  0.08194300  1
  F  F65  1  0.74913100  0.54731400  0.42959300  1
  F  F66  1  0.87306100  0.74601700  0.31126400  1
  F  F67  1  0.54048000  0.08365100  0.31464700  1
  F  F68  1  0.79492700  0.58636400  0.81467500  1
  F  F69  1  0.59039600  0.12392200  0.69820400  1
  F  F70  1  0.93198700  0.80105200  0.54438000  1
  F  F71  1  0.92519300  0.78322800  0.69714100  1
  F  F72  1  0.79593800  0.53823200  0.19831000  1
  F  F73  1  0.74229400  0.20406200  0.19831000  1
  F  F74  1  0.87607800  0.46647400  0.69820400  1
  F  F75  1  0.86561000  0.40120100  0.08194300  1
  F  F76  1  0.79818400  0.25086900  0.42959300  1
  F  F77  1  0.88589200  0.40708700  0.92956300  1
  F  F78  1  0.91634900  0.45682900  0.31464700  1
  F  F79  1  0.79143800  0.20507300  0.81467500  1
  F  F80  1  0.87295600  0.12693900  0.31126400  1
  F  F81  1  0.85803500  0.07480700  0.69714100  1
  F  F82  1  0.86906500  0.06801300  0.54438000  1
  F  F83  1  0.92265100  0.12649500  0.92775300  1
