# CIF generated by HEAS from Alexandria entry agm005236017 data_agm005236017 _cell_length_a 8.39759 _cell_length_b 8.39759 _cell_length_c 8.44341 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 120.00000 _cell_volume 515.65276 _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 Hf1 Hf 0.20047 0.79953 0.94453 1.00000 Hf2 Hf 0.20047 0.40094 0.94453 1.00000 Hf3 Hf 0.59906 0.79953 0.94453 1.00000 Hf4 Hf 0.79953 0.20047 0.05547 1.00000 Hf5 Hf 0.79953 0.59906 0.05547 1.00000 Hf6 Hf 0.40094 0.20047 0.05547 1.00000 Hf7 Hf 0.79953 0.20047 0.44453 1.00000 Hf8 Hf 0.79953 0.59906 0.44453 1.00000 Hf9 Hf 0.40094 0.20047 0.44453 1.00000 Hf10 Hf 0.20047 0.79953 0.55547 1.00000 Hf11 Hf 0.20047 0.40094 0.55547 1.00000 Hf12 Hf 0.59906 0.79953 0.55547 1.00000 Hf13 Hf 0.54125 0.45875 0.75000 1.00000 Hf14 Hf 0.54125 0.08249 0.75000 1.00000 Hf15 Hf 0.91751 0.45875 0.75000 1.00000 Hf16 Hf 0.45875 0.54125 0.25000 1.00000 Hf17 Hf 0.45875 0.91751 0.25000 1.00000 Hf18 Hf 0.08249 0.54125 0.25000 1.00000 B1 B 0.00000 0.00000 0.00000 1.00000 B2 B 0.00000 0.00000 0.50000 1.00000 B3 B 0.33333 0.66667 0.75000 1.00000 B4 B 0.66667 0.33333 0.25000 1.00000 Mo1 Mo 0.89176 0.10824 0.75000 1.00000 Mo2 Mo 0.89176 0.78352 0.75000 1.00000 Mo3 Mo 0.21648 0.10824 0.75000 1.00000 Mo4 Mo 0.10824 0.89176 0.25000 1.00000 Mo5 Mo 0.10824 0.21648 0.25000 1.00000 Mo6 Mo 0.78352 0.89176 0.25000 1.00000