[CIF]
data_Li4Mn5Fe(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.47607600
_cell_length_b   8.59933998
_cell_length_c   8.68745553
_cell_angle_alpha   62.48410689
_cell_angle_beta   63.38805895
_cell_angle_gamma   63.50094323
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Mn5Fe(PO4)6
_chemical_formula_sum   'Li4 Mn5 Fe1 P6 O24'
_cell_volume   478.69706555
_cell_formula_units_Z   1
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  8.27215645  2.07635733  2.63704574  1
  Li  Li1  1  8.05408334  8.20095556  4.80544887  1
  Li  Li2  1  9.84844042  4.17189033  6.27336482  1
  Li  Li3  1  10.75309798  5.71796041  1.93928114  1
  Mn  Mn4  1  3.97484886  2.52840722  7.27133926  1
  Mn  Mn5  1  5.68060614  3.61480359  2.57138103  1
  Mn  Mn6  1  8.04989595  5.14765554  3.68357889  1
  Mn  Mn7  1  2.39679009  1.53379041  1.08784879  1
  Mn  Mn8  1  10.61995077  6.67726752  4.82844766  1
  Fe  Fe9  1  13.73800109  8.66858232  6.22212756  1
  P  P10  1  5.09817642  6.92877586  3.25340459  1
  P  P11  1  6.86823991  2.29222730  5.50156231  1
  P  P12  1  8.29489764  3.53672726  0.40628755  1
  P  P13  1  7.89313743  6.64431852  6.97595080  1
  P  P14  1  9.36017464  7.96507638  1.81018261  1
  P  P15  1  11.02913511  3.29662749  4.05680659  1
  O  O16  1  10.05208245  8.67356708  5.02031219  1
  O  O17  1  11.11700532  5.82767770  6.67455213  1
  O  O18  1  12.10574576  6.47024517  3.36260115  1
  O  O19  1  5.09041350  7.77322801  1.91080050  1
  O  O20  1  5.51175495  7.80626706  4.46736514  1
  O  O21  1  6.10887669  5.77588428  3.14392182  1
  O  O22  1  5.94123338  2.86175004  6.59890709  1
  O  O23  1  7.06618224  3.29802688  4.33135377  1
  O  O24  1  6.88764070  5.52930818  7.29778713  1
  O  O25  1  7.77280067  3.88812171  1.82513844  1
  O  O26  1  7.22360368  8.08292471  6.78994237  1
  O  O27  1  4.09083673  0.59576931  1.37836450  1
  O  O28  1  12.14226394  9.73714223  6.04931372  1
  O  O29  1  8.98158819  2.11619948  0.57751628  1
  O  O30  1  8.46186727  6.33733406  5.54639307  1
  O  O31  1  9.27439108  4.65890175  0.02390143  1
  O  O32  1  9.29678765  6.82558385  2.88950409  1
  O  O33  1  10.25222664  7.32959879  0.65235409  1
  O  O34  1  10.10898080  4.54870146  4.30966122  1
  O  O35  1  10.33913349  2.46555305  2.97711085  1
  O  O36  1  11.06582735  2.58300103  5.48822095  1
  O  O37  1  3.99193823  3.63108313  3.71946405  1
  O  O38  1  5.03302618  4.25592486  0.73135282  1
  O  O39  1  6.27549999  1.52687903  2.25157011  1
[/CIF]
