# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.11624800
_cell_length_b   5.14699144
_cell_length_c   10.43508087
_cell_angle_alpha   84.75376955
_cell_angle_beta   76.70472577
_cell_angle_gamma   70.44226659
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   251.96451946
_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  0.00000000  0.50000000  0.50000000  1
  Li  Li1  1  0.56658600  0.49753500  0.36048500  1
  Li  Li2  1  0.13678900  0.50392500  0.21645500  1
  Li  Li3  1  0.71732600  0.49927200  0.06931800  1
  Li  Li4  1  0.28267400  0.50072800  0.93068200  1
  Li  Li5  1  0.86321100  0.49607500  0.78354500  1
  Li  Li6  1  0.43341400  0.50246500  0.63951500  1
  Li  Li7  1  0.50000000  0.00000000  0.50000000  1
  Mn  Mn8  1  0.93384900  0.99312300  0.64004000  1
  Mn  Mn9  1  0.06615100  0.00687700  0.35996000  1
  Co  Co10  1  0.63472800  0.00389000  0.22256700  1
  Co  Co11  1  0.21287300  0.00504400  0.06956600  1
  Co  Co12  1  0.78712700  0.99495600  0.93043400  1
  Co  Co13  1  0.36527200  0.99611000  0.77743300  1
  O  O14  1  0.69360200  0.77038700  0.64612300  1
  O  O15  1  0.21895200  0.77411300  0.50036400  1
  O  O16  1  0.82668600  0.78178300  0.34855600  1
  O  O17  1  0.36523200  0.78035300  0.22260800  1
  O  O18  1  0.95745000  0.77160000  0.06733300  1
  O  O19  1  0.52403500  0.77415300  0.92773600  1
  O  O20  1  0.10217400  0.76529000  0.77847400  1
  O  O21  1  0.30639800  0.22961300  0.35387700  1
  O  O22  1  0.89782600  0.23471000  0.22152600  1
  O  O23  1  0.47596500  0.22584700  0.07226400  1
  O  O24  1  0.04255000  0.22840000  0.93266700  1
  O  O25  1  0.63476800  0.21964700  0.77739200  1
  O  O26  1  0.17331400  0.21821700  0.65144400  1
  O  O27  1  0.78104800  0.22588700  0.49963600  1
