# CIF generated by HEAS from Alexandria entry agm008604849
data_agm008604849
_cell_length_a     12.07496
_cell_length_b     12.99488
_cell_length_c     14.01532
_cell_angle_alpha  104.06709
_cell_angle_beta   109.52584
_cell_angle_gamma  111.92671
_cell_volume       1744.29503
_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
  Zr1 Zr 0.48570 0.04341 0.70249 1.00000
  Zr2 Zr 0.51430 0.95659 0.29751 1.00000
  Zr3 Zr 0.72197 0.99295 0.62920 1.00000
  Zr4 Zr 0.27803 0.00705 0.37080 1.00000
  Zr5 Zr 0.81640 0.17095 0.90234 1.00000
  Zr6 Zr 0.18360 0.82905 0.09766 1.00000
  Zr7 Zr 0.49767 0.24162 0.59756 1.00000
  Zr8 Zr 0.50233 0.75838 0.40244 1.00000
  Zr9 Zr 0.71053 0.20854 0.51684 1.00000
  Zr10 Zr 0.28947 0.79146 0.48316 1.00000
  Zr11 Zr 0.80117 0.45064 0.72351 1.00000
  Zr12 Zr 0.19883 0.54936 0.27649 1.00000
  Zr13 Zr 0.98353 0.29511 0.76212 1.00000
  Zr14 Zr 0.01647 0.70489 0.23788 1.00000
  Zr15 Zr 0.64016 0.33183 0.85686 1.00000
  Zr16 Zr 0.35984 0.66817 0.14314 1.00000
  Zr17 Zr 0.11874 0.58795 0.90166 1.00000
  Zr18 Zr 0.88126 0.41205 0.09834 1.00000
  Zr19 Zr 0.86999 0.61156 0.96861 1.00000
  Zr20 Zr 0.13001 0.38844 0.03139 1.00000
  Ir1 Ir 0.50000 0.00000 0.50000 1.00000
  Ir2 Ir 0.71888 0.19601 0.71092 1.00000
  Ir3 Ir 0.28112 0.80399 0.28908 1.00000
  Ir4 Ir 0.91026 0.39838 0.90555 1.00000
  Ir5 Ir 0.08974 0.60162 0.09445 1.00000
  I1 I 0.26528 0.82635 0.69529 1.00000
  I2 I 0.73472 0.17365 0.30471 1.00000
  I3 I 0.75873 0.77503 0.56010 1.00000
  I4 I 0.24127 0.22497 0.43990 1.00000
  I5 I 0.64141 0.90013 0.78562 1.00000
  I6 I 0.35859 0.09987 0.21438 1.00000
  I7 I 0.33834 0.17896 0.72465 1.00000
  I8 I 0.66166 0.82104 0.27535 1.00000
  I9 I 0.91767 0.10811 0.55036 1.00000
  I10 I 0.08233 0.89189 0.44964 1.00000
  I11 I 0.62481 0.38949 0.48652 1.00000
  I12 I 0.37519 0.61051 0.51348 1.00000
  I13 I 0.03498 0.12886 0.86916 1.00000
  I14 I 0.96502 0.87114 0.13084 1.00000
  I15 I 0.61226 0.16837 0.97957 1.00000
  I16 I 0.38774 0.83163 0.02043 1.00000
  I17 I 0.01080 0.26216 0.15508 1.00000
  I18 I 0.98920 0.73784 0.84492 1.00000
  I19 I 0.29608 0.47326 0.91791 1.00000
  I20 I 0.70392 0.52674 0.08209 1.00000
  I21 I 0.01281 0.46390 0.64853 1.00000
  I22 I 0.98719 0.53610 0.35147 1.00000
  I23 I 0.59772 0.51328 0.76730 1.00000
  I24 I 0.40228 0.48672 0.23270 1.00000