# generated using pymatgen
data_SrNb2CuO6F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.70751137
_cell_length_b   10.70751137
_cell_length_c   10.70751137
_cell_angle_alpha   159.23197548
_cell_angle_beta   159.23197548
_cell_angle_gamma   29.53584999
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrNb2CuO6F
_chemical_formula_sum   'Sr1 Nb2 Cu1 O6 F1'
_cell_volume   154.26303216
_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
  Sr  Sr0  1  0.00000000  0.00000000  0.00000000  1.0
  Nb  Nb1  1  0.61945500  0.61945500  0.00000000  1.0
  Nb  Nb2  1  0.38054500  0.38054500  0.00000000  1.0
  Cu  Cu3  1  0.75000000  0.25000000  0.50000000  1.0
  O  O4  1  0.70782600  0.70782600  0.00000000  1.0
  O  O5  1  0.59188900  0.09188900  0.50000000  1.0
  O  O6  1  0.90811100  0.40811100  0.50000000  1.0
  O  O7  1  0.29217400  0.29217400  0.00000000  1.0
  O  O8  1  0.09328000  0.59328000  0.50000000  1.0
  O  O9  1  0.40672000  0.90672000  0.50000000  1.0
  F  F10  1  0.50000000  0.50000000  0.00000000  1.0