# CIF generated by HEAS from Alexandria entry agm044983353 data_agm044983353 _cell_length_a 12.15445 _cell_length_b 12.15445 _cell_length_c 20.54088 _cell_angle_alpha 90.00668 _cell_angle_beta 89.99332 _cell_angle_gamma 119.93943 _cell_volume 2629.56999 _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 0.99993 0.24108 0.33333 1.00000 Nd2 Nd 0.75923 0.75923 0.00000 1.00000 Nd3 Nd 0.24108 0.99993 0.66667 1.00000 Al1 Al 0.93375 0.00012 0.16663 1.00000 Al2 Al 0.38696 0.66547 0.06962 1.00000 Al3 Al 0.27845 0.61299 0.40312 1.00000 Al4 Al 0.33476 0.72130 0.73645 1.00000 Al5 Al 0.06642 0.06642 0.50000 1.00000 Al6 Al 0.00012 0.93375 0.83337 1.00000 Al7 Al 0.72130 0.33476 0.26355 1.00000 Al8 Al 0.61299 0.27845 0.59688 1.00000 Al9 Al 0.66547 0.38696 0.93038 1.00000 I1 I 0.34384 0.80094 0.14571 1.00000 I2 I 0.19881 0.54409 0.81296 1.00000 I3 I 0.45587 0.65445 0.47962 1.00000 I4 I 0.71807 0.20472 0.36611 1.00000 I5 I 0.48623 0.28191 0.69941 1.00000 I6 I 0.79567 0.51382 0.03286 1.00000 I7 I 0.20472 0.71807 0.63389 1.00000 I8 I 0.28191 0.48623 0.30059 1.00000 I9 I 0.51382 0.79567 0.96714 1.00000 I10 I 0.94114 0.37695 0.21567 1.00000 I11 I 0.43556 0.05883 0.54891 1.00000 I12 I 0.62478 0.56525 0.88195 1.00000 I13 I 0.37695 0.94114 0.78433 1.00000 I14 I 0.05883 0.43556 0.45109 1.00000 I15 I 0.56525 0.62478 0.11805 1.00000 I16 I 0.14538 0.18801 0.20328 1.00000 I17 I 0.04289 0.85466 0.53658 1.00000 I18 I 0.81185 0.95741 0.86977 1.00000 I19 I 0.18801 0.14538 0.79672 1.00000 I20 I 0.85466 0.04289 0.46342 1.00000 I21 I 0.95741 0.81185 0.13023 1.00000 I22 I 0.20419 0.16286 0.39783 1.00000 I23 I 0.95923 0.79571 0.73131 1.00000 I24 I 0.83770 0.04166 0.06430 1.00000 I25 I 0.16286 0.20419 0.60217 1.00000 I26 I 0.79571 0.95923 0.26869 1.00000 I27 I 0.04166 0.83770 0.93570 1.00000 I28 I 0.19772 0.45924 0.03618 1.00000 I29 I 0.26315 0.80335 0.36961 1.00000 I30 I 0.54024 0.73626 0.70295 1.00000 I31 I 0.45924 0.19772 0.96382 1.00000 I32 I 0.80335 0.26315 0.63039 1.00000 I33 I 0.73626 0.54024 0.29705 1.00000 I34 I 0.54409 0.19881 0.18704 1.00000 I35 I 0.65445 0.45587 0.52038 1.00000 I36 I 0.80094 0.34384 0.85429 1.00000