# generated using pymatgen
data_Mn3NbFe2(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.64214453
_cell_length_b   8.64214453
_cell_length_c   8.64214509
_cell_angle_alpha   60.78104994
_cell_angle_beta   60.78104994
_cell_angle_gamma   60.78104689
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3NbFe2(PO4)6
_chemical_formula_sum   'Mn3 Nb1 Fe2 P6 O24'
_cell_volume   464.44551957
_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
  Mn  Mn0  1  0.14561800  0.14561800  0.14561800  1.0
  Mn  Mn1  1  0.35664600  0.35664600  0.35664600  1.0
  Mn  Mn2  1  0.64343300  0.64343300  0.64343300  1.0
  Nb  Nb3  1  0.85749500  0.85749500  0.85749500  1.0
  Fe  Fe4  1  0.00542500  0.00542500  0.00542500  1.0
  Fe  Fe5  1  0.50041300  0.50041300  0.50041300  1.0
  P  P6  1  0.45063000  0.74830200  0.04522400  1.0
  P  P7  1  0.53960800  0.25616600  0.95566200  1.0
  P  P8  1  0.95566200  0.53960800  0.25616600  1.0
  P  P9  1  0.25616600  0.95566200  0.53960800  1.0
  P  P10  1  0.74830200  0.04522400  0.45063000  1.0
  P  P11  1  0.04522400  0.45063000  0.74830200  1.0
  O  O12  1  0.31263000  0.11003000  0.51207300  1.0
  O  O13  1  0.51207300  0.31263000  0.11003000  1.0
  O  O14  1  0.91179300  0.05906400  0.26027700  1.0
  O  O15  1  0.11003000  0.51207300  0.31263000  1.0
  O  O16  1  0.81733800  0.99127000  0.61525600  1.0
  O  O17  1  0.59376700  0.23828400  0.44767100  1.0
  O  O18  1  0.05906400  0.26027700  0.91179300  1.0
  O  O19  1  0.23828400  0.44767100  0.59376700  1.0
  O  O20  1  0.38754300  0.19083100  0.98887400  1.0
  O  O21  1  0.44767100  0.59376700  0.23828400  1.0
  O  O22  1  0.73851900  0.09055700  0.93560800  1.0
  O  O23  1  0.98887400  0.38754300  0.19083100  1.0
  O  O24  1  0.99127000  0.61525600  0.81733800  1.0
  O  O25  1  0.26027700  0.91179300  0.05906400  1.0
  O  O26  1  0.55984300  0.41082300  0.75840900  1.0
  O  O27  1  0.61525600  0.81733800  0.99127000  1.0
  O  O28  1  0.75840900  0.55984300  0.41082300  1.0
  O  O29  1  0.93560800  0.73851900  0.09055700  1.0
  O  O30  1  0.41082300  0.75840900  0.55984300  1.0
  O  O31  1  0.19083100  0.98887400  0.38754300  1.0
  O  O32  1  0.88822200  0.48853800  0.68815400  1.0
  O  O33  1  0.09055700  0.93560800  0.73851900  1.0
  O  O34  1  0.48853800  0.68815400  0.88822200  1.0
  O  O35  1  0.68815400  0.88822200  0.48853800  1.0