# generated using pymatgen
data_SrNb2CuClO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.95826800
_cell_length_b   3.95826800
_cell_length_c   11.66231300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrNb2CuClO7
_chemical_formula_sum   'Sr1 Nb2 Cu1 Cl1 O7'
_cell_volume   182.72378545
_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  0.50000000  0.50000000  0.00000000  1.0
  Nb  Nb1  1  0.00000000  0.00000000  0.81190500  1.0
  Nb  Nb2  1  0.00000000  0.00000000  0.18809500  1.0
  Cu  Cu3  1  0.00000000  0.00000000  0.50000000  1.0
  Cl  Cl4  1  0.50000000  0.50000000  0.50000000  1.0
  O  O5  1  0.50000000  0.00000000  0.15914600  1.0
  O  O6  1  0.00000000  0.00000000  0.65377800  1.0
  O  O7  1  0.50000000  0.00000000  0.84085400  1.0
  O  O8  1  0.00000000  0.00000000  0.34622200  1.0
  O  O9  1  0.00000000  0.50000000  0.15914600  1.0
  O  O10  1  0.00000000  0.50000000  0.84085400  1.0
  O  O11  1  0.00000000  0.00000000  0.00000000  1.0