# generated using pymatgen
data_Li4Ti2Mn4(FeO6)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.93696800
_cell_length_b   9.11207300
_cell_length_c   25.07677400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Ti2Mn4(FeO6)3
_chemical_formula_sum   'Li8 Ti4 Mn8 Fe6 O36'
_cell_volume   671.10128593
_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  0.17786300  0.99644400  1
  Li  Li1  1  0.00000000  0.18717700  0.20218400  1
  Li  Li2  1  0.00000000  0.31282300  0.70218400  1
  Li  Li3  1  0.00000000  0.32213700  0.49644400  1
  Li  Li4  1  0.00000000  0.67786300  0.50355600  1
  Li  Li5  1  0.00000000  0.68717700  0.29781600  1
  Li  Li6  1  0.00000000  0.81282300  0.79781600  1
  Li  Li7  1  0.00000000  0.82213700  0.00355600  1
  Ti  Ti8  1  0.00000000  0.99629800  0.10575500  1
  Ti  Ti9  1  0.00000000  0.50370200  0.60575500  1
  Ti  Ti10  1  0.00000000  0.49629800  0.39424500  1
  Ti  Ti11  1  0.00000000  0.00370200  0.89424500  1
  Mn  Mn12  1  0.00000000  0.00809700  0.31120700  1
  Mn  Mn13  1  0.50000000  0.14684200  0.58629800  1
  Mn  Mn14  1  0.50000000  0.35315800  0.08629800  1
  Mn  Mn15  1  0.00000000  0.49190300  0.81120700  1
  Mn  Mn16  1  0.00000000  0.50809700  0.18879300  1
  Mn  Mn17  1  0.50000000  0.64684200  0.91370200  1
  Mn  Mn18  1  0.50000000  0.85315800  0.41370200  1
  Mn  Mn19  1  0.00000000  0.99190300  0.68879300  1
  Fe  Fe20  1  0.00000000  0.00000000  0.50000000  1
  Fe  Fe21  1  0.50000000  0.15356500  0.80432600  1
  Fe  Fe22  1  0.50000000  0.34643500  0.30432600  1
  Fe  Fe23  1  0.00000000  0.50000000  0.00000000  1
  Fe  Fe24  1  0.50000000  0.65356500  0.69567400  1
  Fe  Fe25  1  0.50000000  0.84643500  0.19567400  1
  O  O26  1  0.00000000  0.99303900  0.41934700  1
  O  O27  1  0.00000000  0.00696100  0.58065300  1
  O  O28  1  0.50000000  0.04212400  0.94230500  1
  O  O29  1  0.50000000  0.05269500  0.16051500  1
  O  O30  1  0.50000000  0.11627500  0.66169600  1
  O  O31  1  0.00000000  0.12494800  0.75292900  1
  O  O32  1  0.50000000  0.15461700  0.50779400  1
  O  O33  1  0.50000000  0.12906300  0.28555900  1
  O  O34  1  0.00000000  0.18594700  0.85803200  1
  O  O35  1  0.00000000  0.21511000  0.08624600  1
  O  O36  1  0.00000000  0.28489000  0.58624600  1
  O  O37  1  0.00000000  0.31405300  0.35803200  1
  O  O38  1  0.50000000  0.37093700  0.78555900  1
  O  O39  1  0.50000000  0.34538300  0.00779400  1
  O  O40  1  0.00000000  0.37505200  0.25292900  1
  O  O41  1  0.50000000  0.38372500  0.16169600  1
  O  O42  1  0.50000000  0.44730500  0.66051500  1
  O  O43  1  0.50000000  0.45787600  0.44230500  1
  O  O44  1  0.00000000  0.49303900  0.08065300  1
  O  O45  1  0.00000000  0.50696100  0.91934700  1
  O  O46  1  0.50000000  0.54212400  0.55769500  1
  O  O47  1  0.50000000  0.55269500  0.33948500  1
  O  O48  1  0.50000000  0.61627500  0.83830400  1
  O  O49  1  0.00000000  0.62494800  0.74707100  1
  O  O50  1  0.50000000  0.65461700  0.99220600  1
  O  O51  1  0.50000000  0.62906300  0.21444100  1
  O  O52  1  0.00000000  0.68594700  0.64196800  1
  O  O53  1  0.00000000  0.71511000  0.41375400  1
  O  O54  1  0.00000000  0.78489000  0.91375400  1
  O  O55  1  0.00000000  0.81405300  0.14196800  1
  O  O56  1  0.50000000  0.87093700  0.71444100  1
  O  O57  1  0.50000000  0.84538300  0.49220600  1
  O  O58  1  0.00000000  0.87505200  0.24707100  1
  O  O59  1  0.50000000  0.88372500  0.33830400  1
  O  O60  1  0.50000000  0.94730500  0.83948500  1
  O  O61  1  0.50000000  0.95787600  0.05769500  1
