# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.07683500
_cell_length_b   5.12577328
_cell_length_c   10.14858074
_cell_angle_alpha   99.72407212
_cell_angle_beta   101.20204316
_cell_angle_gamma   97.93254089
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   251.32329444
_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  0.35983200  0.43111900  0.84802100  1
  Li  Li1  1  0.50000000  0.00000000  0.00000000  1
  Li  Li2  1  0.21811200  0.85879400  0.70640100  1
  Li  Li3  1  0.06691200  0.27259500  0.56483700  1
  Li  Li4  1  0.93308800  0.72740500  0.43516300  1
  Li  Li5  1  0.78188800  0.14120600  0.29359900  1
  Li  Li6  1  0.64016800  0.56888100  0.15197900  1
  Li  Li7  1  0.50000000  0.00000000  0.50000000  1
  Mn  Mn8  1  0.92419000  0.71323200  0.92595800  1
  Mn  Mn9  1  0.07581000  0.28676800  0.07404200  1
  Co  Co10  1  0.21692800  0.85854400  0.22021900  1
  Co  Co11  1  0.36697200  0.42058100  0.36189900  1
  Co  Co12  1  0.63302800  0.57941900  0.63810100  1
  Co  Co13  1  0.78307200  0.14145600  0.77978100  1
  O  O14  1  0.59038500  0.78059100  0.83182700  1
  O  O15  1  0.74815000  0.37409900  0.96185700  1
  O  O16  1  0.46418900  0.21793600  0.68730800  1
  O  O17  1  0.29834000  0.62210800  0.54004300  1
  O  O18  1  0.14845700  0.06483700  0.37788800  1
  O  O19  1  0.01295800  0.47573800  0.23829200  1
  O  O20  1  0.88937000  0.93898900  0.09945600  1
  O  O21  1  0.11063000  0.06101100  0.90054400  1
  O  O22  1  0.25185000  0.62590100  0.03814300  1
  O  O23  1  0.98704200  0.52426200  0.76170800  1
  O  O24  1  0.85154300  0.93516300  0.62211200  1
  O  O25  1  0.70166000  0.37789200  0.45995700  1
  O  O26  1  0.53581100  0.78206400  0.31269200  1
  O  O27  1  0.40961500  0.21940900  0.16817300  1
