# generated using pymatgen
data_Li2Mn3NiO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.28384600
_cell_length_b   8.28384600
_cell_length_c   8.28384600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Mn3NiO8
_chemical_formula_sum   'Li8 Mn12 Ni4 O32'
_cell_volume   568.45494630
_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  0.00373400  0.00373400  0.00373400  1
  Li  Li1  1  0.24626600  0.24626600  0.24626600  1
  Li  Li2  1  0.25373400  0.75373400  0.74626600  1
  Li  Li3  1  0.49626600  0.99626600  0.50373400  1
  Li  Li4  1  0.50373400  0.49626600  0.99626600  1
  Li  Li5  1  0.74626600  0.25373400  0.75373400  1
  Li  Li6  1  0.75373400  0.74626600  0.25373400  1
  Li  Li7  1  0.99626600  0.50373400  0.49626600  1
  Mn  Mn8  1  0.12118000  0.12882000  0.62500000  1
  Mn  Mn9  1  0.12500000  0.37882000  0.87118000  1
  Mn  Mn10  1  0.12882000  0.62500000  0.12118000  1
  Mn  Mn11  1  0.37118000  0.37500000  0.62118000  1
  Mn  Mn12  1  0.37500000  0.62118000  0.37118000  1
  Mn  Mn13  1  0.37882000  0.87118000  0.12500000  1
  Mn  Mn14  1  0.62118000  0.37118000  0.37500000  1
  Mn  Mn15  1  0.62500000  0.12118000  0.12882000  1
  Mn  Mn16  1  0.62882000  0.87500000  0.87882000  1
  Mn  Mn17  1  0.87118000  0.12500000  0.37882000  1
  Mn  Mn18  1  0.87500000  0.87882000  0.62882000  1
  Mn  Mn19  1  0.87882000  0.62882000  0.87500000  1
  Ni  Ni20  1  0.12500000  0.87500000  0.37500000  1
  Ni  Ni21  1  0.37500000  0.12500000  0.87500000  1
  Ni  Ni22  1  0.62500000  0.62500000  0.62500000  1
  Ni  Ni23  1  0.87500000  0.37500000  0.12500000  1
  O  O24  1  0.10129900  0.12388600  0.39210300  1
  O  O25  1  0.10789700  0.89870100  0.62388600  1
  O  O26  1  0.11553000  0.61553000  0.88447000  1
  O  O27  1  0.12388600  0.39210300  0.10129900  1
  O  O28  1  0.12611400  0.14870100  0.85789700  1
  O  O29  1  0.13447000  0.36553000  0.63447000  1
  O  O30  1  0.14210300  0.62611400  0.35129900  1
  O  O31  1  0.14870100  0.85789700  0.12611400  1
  O  O32  1  0.35129900  0.14210300  0.62611400  1
  O  O33  1  0.35789700  0.37388600  0.85129900  1
  O  O34  1  0.36553000  0.63447000  0.13447000  1
  O  O35  1  0.37388600  0.85129900  0.35789700  1
  O  O36  1  0.37611400  0.60789700  0.60129900  1
  O  O37  1  0.38447000  0.38447000  0.38447000  1
  O  O38  1  0.39210300  0.10129900  0.12388600  1
  O  O39  1  0.39870100  0.87611400  0.89210300  1
  O  O40  1  0.60129900  0.37611400  0.60789700  1
  O  O41  1  0.60789700  0.60129900  0.37611400  1
  O  O42  1  0.61553000  0.88447000  0.11553000  1
  O  O43  1  0.62388600  0.10789700  0.89870100  1
  O  O44  1  0.62611400  0.35129900  0.14210300  1
  O  O45  1  0.63447000  0.13447000  0.36553000  1
  O  O46  1  0.64210300  0.87388600  0.64870100  1
  O  O47  1  0.64870100  0.64210300  0.87388600  1
  O  O48  1  0.85129900  0.35789700  0.37388600  1
  O  O49  1  0.85789700  0.12611400  0.14870100  1
  O  O50  1  0.86553000  0.86553000  0.86553000  1
  O  O51  1  0.87388600  0.64870100  0.64210300  1
  O  O52  1  0.87611400  0.89210300  0.39870100  1
  O  O53  1  0.88447000  0.11553000  0.61553000  1
  O  O54  1  0.89210300  0.39870100  0.87611400  1
  O  O55  1  0.89870100  0.62388600  0.10789700  1
