# CIF generated by HEAS from Alexandria entry agm004046800 data_agm004046800 _cell_length_a 5.13967 _cell_length_b 3.63818 _cell_length_c 6.03512 _cell_angle_alpha 72.47390 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 107.61237 _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 Br1 Br 0.00000 0.70210 0.47045 1.00000 Sc1 Sc 0.50000 0.54357 0.78835 1.00000 Y1 Y 0.00000 0.97443 0.92639 1.00000 Y2 Y 0.50000 0.27990 0.31481 1.00000