# generated using pymatgen
data_NbV3Fe2(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.65181947
_cell_length_b   8.65181947
_cell_length_c   8.65181877
_cell_angle_alpha   60.60688370
_cell_angle_beta   60.60688370
_cell_angle_gamma   60.60688915
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbV3Fe2(PO4)6
_chemical_formula_sum   'Nb1 V3 Fe2 P6 O24'
_cell_volume   464.21514391
_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  0.14286000  0.14286000  0.14286000  1.0
  V  V1  1  0.64205200  0.64205200  0.64205200  1.0
  V  V2  1  0.85582700  0.85582700  0.85582700  1.0
  V  V3  1  0.35827400  0.35827400  0.35827400  1.0
  Fe  Fe4  1  0.99507500  0.99507500  0.99507500  1.0
  Fe  Fe5  1  0.49931200  0.49931200  0.49931200  1.0
  P  P6  1  0.54838300  0.95559500  0.25248600  1.0
  P  P7  1  0.25248600  0.54838300  0.95559500  1.0
  P  P8  1  0.95559500  0.25248600  0.54838300  1.0
  P  P9  1  0.04222100  0.74520600  0.46179100  1.0
  P  P10  1  0.74520600  0.46179100  0.04222100  1.0
  P  P11  1  0.46179100  0.04222100  0.74520600  1.0
  O  O12  1  0.31175200  0.50516100  0.11389700  1.0
  O  O13  1  0.11389700  0.31175200  0.50516100  1.0
  O  O14  1  0.50516100  0.11389700  0.31175200  1.0
  O  O15  1  0.73807700  0.94024500  0.08861000  1.0
  O  O16  1  0.38347500  0.00398500  0.18700800  1.0
  O  O17  1  0.55531300  0.76208400  0.40878700  1.0
  O  O18  1  0.08861000  0.73807700  0.94024500  1.0
  O  O19  1  0.40878700  0.55531300  0.76208400  1.0
  O  O20  1  0.00481800  0.81267200  0.61342200  1.0
  O  O21  1  0.76208400  0.40878700  0.55531300  1.0
  O  O22  1  0.06186500  0.91000900  0.26280900  1.0
  O  O23  1  0.81267200  0.61342200  0.00481800  1.0
  O  O24  1  0.18700800  0.38347500  0.00398500  1.0
  O  O25  1  0.94024500  0.08861000  0.73807700  1.0
  O  O26  1  0.23868900  0.58991100  0.44044500  1.0
  O  O27  1  0.00398500  0.18700800  0.38347500  1.0
  O  O28  1  0.58991100  0.44044500  0.23868900  1.0
  O  O29  1  0.91000900  0.26280900  0.06186500  1.0
  O  O30  1  0.44044500  0.23868900  0.58991100  1.0
  O  O31  1  0.61342200  0.00481800  0.81267200  1.0
  O  O32  1  0.26280900  0.06186500  0.91000900  1.0
  O  O33  1  0.49244000  0.88516600  0.69029000  1.0
  O  O34  1  0.88516600  0.69029000  0.49244000  1.0
  O  O35  1  0.69029000  0.49244000  0.88516600  1.0