# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.98264532
_cell_length_b   5.96135060
_cell_length_c   14.31714736
_cell_angle_alpha   82.98939104
_cell_angle_beta   95.37947361
_cell_angle_gamma   93.99838466
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   251.11332873
_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  0.99940700  0.49968900  0.99681100  1
  Li  Li1  1  0.57040200  0.21681500  0.14570600  1
  Li  Li2  1  0.14906800  0.93835700  0.29410900  1
  Li  Li3  1  0.42851400  0.78468300  0.85412500  1
  Li  Li4  1  0.85472300  0.07237900  0.71243300  1
  Li  Li5  1  0.28200900  0.35125000  0.56585800  1
  Li  Li6  1  0.72427000  0.62809200  0.43145200  1
  Li  Li7  1  0.70080500  0.15575500  0.43128200  1
  Mn  Mn8  1  0.99940300  0.00440500  0.99869200  1
  Mn  Mn9  1  0.58328000  0.70659400  0.14475600  1
  Co  Co10  1  0.14991300  0.41863900  0.29177000  1
  Co  Co11  1  0.27658000  0.86720500  0.56509800  1
  Co  Co12  1  0.85679600  0.57183100  0.71136900  1
  Co  Co13  1  0.42474700  0.29087200  0.85436500  1
  O  O14  1  0.46444700  0.24993400  0.99190900  1
  O  O15  1  0.04418300  0.95631100  0.14039700  1
  O  O16  1  0.66150800  0.64409100  0.28382700  1
  O  O17  1  0.89443000  0.52956400  0.84759400  1
  O  O18  1  0.32233300  0.81023500  0.70188900  1
  O  O19  1  0.75316700  0.08717700  0.57191400  1
  O  O20  1  0.20276900  0.39802600  0.41773500  1
  O  O21  1  0.53789100  0.75422300  0.00546300  1
  O  O22  1  0.11013400  0.46705100  0.15299100  1
  O  O23  1  0.62840300  0.21254800  0.28841000  1
  O  O24  1  0.95893100  0.04795100  0.86012000  1
  O  O25  1  0.38670600  0.33399100  0.72015400  1
  O  O26  1  0.81365900  0.61786500  0.57769000  1
  O  O27  1  0.22151900  0.88446400  0.44208000  1
