# CIF generated by HEAS from Alexandria entry agm005776944
data_agm005776944
_cell_length_a     9.97031
_cell_length_b     9.97031
_cell_length_c     9.97031
_cell_angle_alpha  107.78470
_cell_angle_beta   107.78470
_cell_angle_gamma  107.78470
_cell_volume       807.09317
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
  'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
  Nd1 Nd 0.96359 0.68655 0.89171 1.00000
  Nd2 Nd 0.31345 0.10829 0.03641 1.00000
  Nd3 Nd 0.10829 0.03641 0.31345 1.00000
  Nd4 Nd 0.50000 0.50000 0.50000 1.00000
  Nd5 Nd 0.89171 0.96359 0.68655 1.00000
  Nd6 Nd 0.68655 0.89171 0.96359 1.00000
  Nd7 Nd 0.03641 0.31345 0.10829 1.00000
  Cu1 Cu 0.00000 0.00000 0.00000 1.00000
  I1 I 0.92318 0.31489 0.77268 1.00000
  I2 I 0.68511 0.22732 0.07682 1.00000
  I3 I 0.47603 0.15522 0.39307 1.00000
  I4 I 0.84478 0.60693 0.52397 1.00000
  I5 I 0.22732 0.07682 0.68511 1.00000
  I6 I 0.60693 0.52397 0.84478 1.00000
  I7 I 0.39307 0.47603 0.15522 1.00000
  I8 I 0.77268 0.92318 0.31489 1.00000
  I9 I 0.15522 0.39307 0.47603 1.00000
  I10 I 0.52397 0.84478 0.60693 1.00000
  I11 I 0.31489 0.77268 0.92318 1.00000
  I12 I 0.07682 0.68511 0.22732 1.00000