# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.76673943
_cell_length_b   7.76673943
_cell_length_c   12.93785592
_cell_angle_alpha   62.55046317
_cell_angle_beta   62.55046317
_cell_angle_gamma   21.48593481
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   252.43690430
_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  0.65457800  0.65457800  0.76433100  1
  Li  Li1  1  0.91288800  0.91288800  0.37778000  1
  Li  Li2  1  0.22374200  0.22374200  0.91591200  1
  Li  Li3  1  0.07056900  0.07056900  0.64113800  1
  Li  Li4  1  0.35678700  0.35678700  0.22397500  1
  Li  Li5  1  0.49708200  0.49708200  0.50783400  1
  Li  Li6  1  0.78410000  0.78410000  0.06855800  1
  Li  Li7  1  0.28650000  0.28650000  0.57075700  1
  Mn  Mn8  1  0.00054100  0.00054100  0.00393200  1
  Mn  Mn9  1  0.14422600  0.14422600  0.28350200  1
  Co  Co10  1  0.57186000  0.57186000  0.14361600  1
  Co  Co11  1  0.85391000  0.85391000  0.69665500  1
  Co  Co12  1  0.42645200  0.42645200  0.85104100  1
  Co  Co13  1  0.71607900  0.71607900  0.44508000  1
  O  O14  1  0.59416900  0.59416900  0.98182700  1
  O  O15  1  0.89419800  0.89419800  0.54225600  1
  O  O16  1  0.16456200  0.16456200  0.11811500  1
  O  O17  1  0.02472600  0.02472600  0.84278800  1
  O  O18  1  0.31734500  0.31734500  0.38928600  1
  O  O19  1  0.45895700  0.45895700  0.68830600  1
  O  O20  1  0.73828900  0.73828900  0.24649400  1
  O  O21  1  0.67462300  0.67462300  0.59839500  1
  O  O22  1  0.97935400  0.97935400  0.16688000  1
  O  O23  1  0.25289900  0.25289900  0.75130600  1
  O  O24  1  0.11749500  0.11749500  0.44078900  1
  O  O25  1  0.40594900  0.40594900  0.03917200  1
  O  O26  1  0.55018300  0.55018300  0.30461300  1
  O  O27  1  0.82793900  0.82793900  0.89566100  1
