# CIF generated by HEAS from Alexandria entry agm017881746 data_agm017881746 _cell_length_a 13.73012 _cell_length_b 13.73012 _cell_length_c 4.20410 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 120.00000 _cell_volume 686.36068 _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 Y1 Y 0.00000 0.56069 0.50000 1.00000 Y2 Y 0.56069 0.00000 0.50000 1.00000 Y3 Y 0.43931 0.43931 0.50000 1.00000 Th1 Th 0.00000 0.18828 0.00000 1.00000 Th2 Th 0.18828 0.00000 0.00000 1.00000 Th3 Th 0.81172 0.81172 0.00000 1.00000 Th4 Th 0.33333 0.66667 0.50000 1.00000 Th5 Th 0.66667 0.33333 0.50000 1.00000 As1 As 0.00000 0.82347 0.50000 1.00000 As2 As 0.82347 0.00000 0.50000 1.00000 As3 As 0.17653 0.17653 0.50000 1.00000 As4 As 0.31127 0.48408 0.00000 1.00000 As5 As 0.17280 0.68873 0.00000 1.00000 As6 As 0.51592 0.82720 0.00000 1.00000 As7 As 0.82720 0.51592 0.00000 1.00000 As8 As 0.48408 0.31127 0.00000 1.00000 As9 As 0.68873 0.17280 0.00000 1.00000 As10 As 0.00000 0.35473 0.50000 1.00000 As11 As 0.35473 0.00000 0.50000 1.00000 As12 As 0.64527 0.64527 0.50000 1.00000 Pd1 Pd 0.00000 0.72692 0.00000 1.00000 Pd2 Pd 0.72692 0.00000 0.00000 1.00000 Pd3 Pd 0.27308 0.27308 0.00000 1.00000 Pd4 Pd 0.19231 0.37516 0.50000 1.00000 Pd5 Pd 0.18285 0.80769 0.50000 1.00000 Pd6 Pd 0.62484 0.81715 0.50000 1.00000 Pd7 Pd 0.81715 0.62484 0.50000 1.00000 Pd8 Pd 0.37516 0.19231 0.50000 1.00000 Pd9 Pd 0.80769 0.18285 0.50000 1.00000 Pd10 Pd 0.12187 0.48201 0.00000 1.00000 Pd11 Pd 0.36014 0.87813 0.00000 1.00000 Pd12 Pd 0.51799 0.63986 0.00000 1.00000 Pd13 Pd 0.63986 0.51799 0.00000 1.00000 Pd14 Pd 0.48201 0.12187 0.00000 1.00000 Pd15 Pd 0.87813 0.36014 0.00000 1.00000 Pd16 Pd 0.00000 0.00000 0.50000 1.00000