# CIF generated by HEAS from Alexandria entry agm005608043 data_agm005608043 _cell_length_a 3.43746 _cell_length_b 5.31552 _cell_length_c 5.31553 _cell_angle_alpha 120.00002 _cell_angle_beta 89.99983 _cell_angle_gamma 90.00009 _cell_volume 84.11240 _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 0.00000 0.00000 0.00000 1.00000 B1 B 0.50000 0.33716 0.33716 1.00000 B2 B 0.50000 0.66284 0.66284 1.00000 B3 B 0.50000 1.00000 0.66284 1.00000 B4 B 0.50000 0.66284 1.00000 1.00000 B5 B 0.50000 0.33716 1.00000 1.00000 B6 B 0.50000 0.00000 0.33716 1.00000 Mo1 Mo 0.00000 0.33333 0.66667 1.00000 Mo2 Mo 1.00000 0.66667 0.33333 1.00000