# CIF generated by HEAS from Alexandria entry agm004875773
data_agm004875773
_cell_length_a     4.51221
_cell_length_b     4.63322
_cell_length_c     6.18835
_cell_angle_alpha  68.28882
_cell_angle_beta   68.61867
_cell_angle_gamma  60.86023
_cell_volume       102.23582
_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
  Th1 Th 0.50000 0.50000 0.50000 1.00000
  Cu1 Cu 0.00000 0.00000 0.00000 1.00000
  H1 H 0.94159 0.43023 0.68659 1.00000
  H2 H 0.75359 0.39447 0.09835 1.00000
  H3 H 0.05841 0.56977 0.31341 1.00000
  H4 H 0.24641 0.60553 0.90165 1.00000
  H5 H 0.58167 0.03239 0.31353 1.00000
  H6 H 0.41833 0.96761 0.68647 1.00000
  H7 H 0.07241 0.03239 0.31353 1.00000
  H8 H 0.92759 0.96761 0.68647 1.00000
  Ir1 Ir 0.28746 0.27735 0.14773 1.00000
  Ir2 Ir 0.71254 0.72265 0.85227 1.00000