# generated using pymatgen
data_NbCr2Fe3(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.77078530
_cell_length_b   8.77078530
_cell_length_c   8.77078475
_cell_angle_alpha   59.65525180
_cell_angle_beta   59.65525180
_cell_angle_gamma   59.65524970
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbCr2Fe3(PO4)6
_chemical_formula_sum   'Nb1 Cr2 Fe3 P6 O24'
_cell_volume   473.35302126
_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
  Nb  Nb0  1  0.85532000  0.85532000  0.85532000  1.0
  Cr  Cr1  1  0.00869800  0.00869800  0.00869800  1.0
  Cr  Cr2  1  0.50071000  0.50071000  0.50071000  1.0
  Fe  Fe3  1  0.14898600  0.14898600  0.14898600  1.0
  Fe  Fe4  1  0.35473800  0.35473800  0.35473800  1.0
  Fe  Fe5  1  0.64426400  0.64426400  0.64426400  1.0
  P  P6  1  0.45055800  0.74786100  0.04383600  1.0
  P  P7  1  0.54004100  0.25405400  0.95640100  1.0
  P  P8  1  0.95640100  0.54004100  0.25405400  1.0
  P  P9  1  0.25405400  0.95640100  0.54004100  1.0
  P  P10  1  0.74786100  0.04383600  0.45055800  1.0
  P  P11  1  0.04383600  0.45055800  0.74786100  1.0
  O  O12  1  0.31043000  0.11309300  0.50504000  1.0
  O  O13  1  0.50504000  0.31043000  0.11309300  1.0
  O  O14  1  0.91351100  0.05972800  0.26159300  1.0
  O  O15  1  0.11309300  0.50504000  0.31043000  1.0
  O  O16  1  0.81598600  0.99018500  0.61386000  1.0
  O  O17  1  0.58937400  0.23649900  0.44513300  1.0
  O  O18  1  0.05972800  0.26159300  0.91351100  1.0
  O  O19  1  0.23649900  0.44513300  0.58937400  1.0
  O  O20  1  0.39055800  0.18356700  0.99875100  1.0
  O  O21  1  0.44513300  0.58937400  0.23649900  1.0
  O  O22  1  0.73842100  0.08863500  0.93423600  1.0
  O  O23  1  0.99875100  0.39055800  0.18356700  1.0
  O  O24  1  0.99018500  0.61386000  0.81598600  1.0
  O  O25  1  0.26159300  0.91351100  0.05972800  1.0
  O  O26  1  0.56048700  0.41216000  0.76172700  1.0
  O  O27  1  0.61386000  0.81598600  0.99018500  1.0
  O  O28  1  0.76172700  0.56048700  0.41216000  1.0
  O  O29  1  0.93423600  0.73842100  0.08863500  1.0
  O  O30  1  0.41216000  0.76172700  0.56048700  1.0
  O  O31  1  0.18356700  0.99875100  0.39055800  1.0
  O  O32  1  0.88750700  0.49935100  0.68470100  1.0
  O  O33  1  0.08863500  0.93423600  0.73842100  1.0
  O  O34  1  0.49935100  0.68470100  0.88750700  1.0
  O  O35  1  0.68470100  0.88750700  0.49935100  1.0