# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.13149400
_cell_length_b   7.66964066
_cell_length_c   7.74670700
_cell_angle_alpha   119.38280575
_cell_angle_beta   83.75339861
_cell_angle_gamma   108.66666235
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   251.26013852
_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  0.50127400  0.92922600  0.85330100  1
  Li  Li1  1  0.49347200  0.78850000  0.56452800  1
  Li  Li2  1  0.50652800  0.21150000  0.43547200  1
  Li  Li3  1  0.49872600  0.07077400  0.14669900  1
  Li  Li4  1  0.50000000  0.50000000  0.00000000  1
  Li  Li5  1  0.50788800  0.36637100  0.70321600  1
  Li  Li6  1  0.49211200  0.63362900  0.29678400  1
  Li  Li7  1  0.00000000  0.50000000  0.50000000  1
  Mn  Mn8  1  0.00580100  0.78410800  0.07460400  1
  Mn  Mn9  1  0.99419900  0.21589200  0.92539600  1
  Co  Co10  1  0.00451600  0.64622100  0.77778200  1
  Co  Co11  1  0.99548400  0.35377900  0.22221800  1
  Co  Co12  1  0.00774700  0.08691900  0.63278000  1
  Co  Co13  1  0.99225300  0.91308100  0.36722000  1
  O  O14  1  0.78043300  0.93437700  0.09860700  1
  O  O15  1  0.78952600  0.78782100  0.82982300  1
  O  O16  1  0.77286700  0.20926000  0.69832200  1
  O  O17  1  0.76174200  0.07577200  0.39849100  1
  O  O18  1  0.77638700  0.51154000  0.23176000  1
  O  O19  1  0.77033900  0.35097200  0.96282600  1
  O  O20  1  0.75826400  0.66065800  0.53173900  1
  O  O21  1  0.23825800  0.92422800  0.60150900  1
  O  O22  1  0.22713300  0.79074000  0.30167800  1
  O  O23  1  0.21047400  0.21217900  0.17017700  1
  O  O24  1  0.21956700  0.06562300  0.90139300  1
  O  O25  1  0.22361300  0.48846000  0.76823900  1
  O  O26  1  0.24173600  0.33934200  0.46826100  1
  O  O27  1  0.22966100  0.64902800  0.03717400  1
