# CIF generated by HEAS from Alexandria entry agm005508693 data_agm005508693 _cell_length_a 6.54187 _cell_length_b 6.54187 _cell_length_c 12.06032 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 120.00000 _cell_volume 446.98565 _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 0.00000 0.00000 1.00000 Y2 Y 0.00000 0.00000 0.50000 1.00000 Y3 Y 0.83302 0.66604 0.25000 1.00000 Y4 Y 0.16698 0.33396 0.75000 1.00000 Y5 Y 0.33396 0.16698 0.25000 1.00000 Y6 Y 0.83302 0.16698 0.25000 1.00000 Y7 Y 0.16698 0.83302 0.75000 1.00000 Y8 Y 0.66604 0.83302 0.75000 1.00000 Br1 Br 0.33333 0.66667 0.94765 1.00000 Br2 Br 0.66667 0.33333 0.44765 1.00000 Br3 Br 0.66667 0.33333 0.05235 1.00000 Br4 Br 0.33333 0.66667 0.55235 1.00000