data_nolabel
_cell_length_a     5.28640000000000
_cell_length_b     5.28640000000000
_cell_length_c     10.4102
_cell_angle_alpha  90
_cell_angle_beta   90
_cell_angle_gamma  90
_symmetry_space_group_name_H-M  'I-42d'
loop_
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
  Cu     0.00000000  0.00000000  0.00000000
  Fe     0.50000000  0.50000000  0.00000000
  S      0.25700000  0.25000000  0.12500000
