# generated using pymatgen
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  0.74261300  0.15098700  0.35934500  1
  Li  Li1  1  0.26520100  0.84911400  0.65482900  1
  Li  Li2  1  0.65198800  0.25944300  0.85485900  1
  Li  Li3  1  0.85053700  0.65561200  0.26426200  1
  Mn  Mn4  1  0.01361400  0.00092600  0.99085100  1
  Mn  Mn5  1  0.34914200  0.35385000  0.35039700  1
  Mn  Mn6  1  0.49160800  0.50291700  0.50195400  1
  Mn  Mn7  1  0.14668200  0.15028600  0.14823900  1
  Mn  Mn8  1  0.65657300  0.65009100  0.65796300  1
  Fe  Fe9  1  0.84854100  0.84604800  0.84787700  1
  P  P10  1  0.05674100  0.75373600  0.44333500  1
  P  P11  1  0.44349300  0.04997500  0.74968700  1
  P  P12  1  0.75346300  0.44125400  0.05536400  1
  P  P13  1  0.24624900  0.54905300  0.95059900  1
  P  P14  1  0.55947000  0.95341700  0.24667000  1
  P  P15  1  0.93623500  0.24558000  0.55281300  1
  O  O16  1  0.46406400  0.90084400  0.68410800  1
  O  O17  1  0.68734200  0.45651900  0.90952800  1
  O  O18  1  0.90585400  0.68923500  0.45821500  1
  O  O19  1  0.06276900  0.92395500  0.26038100  1
  O  O20  1  0.00273100  0.81306100  0.60875900  1
  O  O21  1  0.24841200  0.60886300  0.42841600  1
  O  O22  1  0.25435400  0.07453700  0.89922000  1
  O  O23  1  0.45703000  0.23339200  0.59022500  1
  O  O24  1  0.17963500  0.38966900  0.99445500  1
  O  O25  1  0.61136800  0.42298700  0.24870800  1
  O  O26  1  0.09048300  0.74436500  0.92525200  1
  O  O27  1  0.38946800  0.01531100  0.18782700  1
  O  O28  1  0.60471200  0.99268200  0.82432800  1
  O  O29  1  0.91081300  0.24895700  0.07869700  1
  O  O30  1  0.39168500  0.57357300  0.75579600  1
  O  O31  1  0.81914100  0.60429700  0.00325700  1
  O  O32  1  0.57350400  0.75672300  0.39374700  1
  O  O33  1  0.75091500  0.92301000  0.08889500  1
  O  O34  1  0.74336700  0.39688100  0.58726900  1
  O  O35  1  0.94924100  0.18623700  0.40568500  1
  O  O36  1  0.92218000  0.08835900  0.74786900  1
  O  O37  1  0.10054500  0.30423800  0.50684400  1
  O  O38  1  0.31262000  0.52006000  0.09966000  1
  O  O39  1  0.55562400  0.09695600  0.30681700  1
