# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.99306000
_cell_length_b   5.96850337
_cell_length_c   8.71414373
_cell_angle_alpha   88.62802915
_cell_angle_beta   86.44899133
_cell_angle_gamma   78.03235167
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   253.54246188
_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  0.28329900  0.92913900  0.42807200  1
  Li  Li1  1  0.85543000  0.78839600  0.27971700  1
  Li  Li2  1  0.71670100  0.07086100  0.57192800  1
  Li  Li3  1  0.14457000  0.21160400  0.72028300  1
  Li  Li4  1  0.42465900  0.64361000  0.14129300  1
  Li  Li5  1  0.00000000  0.50000000  0.00000000  1
  Li  Li6  1  0.57534100  0.35639000  0.85870700  1
  Li  Li7  1  0.00000000  0.00000000  0.00000000  1
  Mn  Mn8  1  0.71160000  0.57437400  0.57487800  1
  Mn  Mn9  1  0.28840000  0.42562600  0.42512200  1
  Co  Co10  1  0.85985800  0.28122700  0.28245900  1
  Co  Co11  1  0.43126900  0.12794200  0.13780800  1
  Co  Co12  1  0.56873100  0.87205800  0.86219200  1
  Co  Co13  1  0.14014200  0.71877300  0.71754100  1
  O  O14  1  0.56665100  0.60097200  0.36918700  1
  O  O15  1  0.13008200  0.45852300  0.22179700  1
  O  O16  1  0.99531800  0.74536000  0.51497100  1
  O  O17  1  0.41456900  0.88837200  0.65824800  1
  O  O18  1  0.69360400  0.30918200  0.09016200  1
  O  O19  1  0.30673600  0.16783600  0.93943300  1
  O  O20  1  0.83225300  0.01745500  0.79114000  1
  O  O21  1  0.00468200  0.25464000  0.48502900  1
  O  O22  1  0.58543100  0.11162800  0.34175200  1
  O  O23  1  0.43334900  0.39902800  0.63081300  1
  O  O24  1  0.86991800  0.54147700  0.77820300  1
  O  O25  1  0.16774700  0.98254500  0.20886000  1
  O  O26  1  0.69326400  0.83216400  0.06056700  1
  O  O27  1  0.30639600  0.69081800  0.90983800  1
