# CIF generated by HEAS from Alexandria entry agm048349449 data_agm048349449 _cell_length_a 6.28740 _cell_length_b 3.64518 _cell_length_c 7.87089 _cell_angle_alpha 90.00000 _cell_angle_beta 105.59846 _cell_angle_gamma 90.00000 _cell_volume 173.74692 _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 Sc1 Sc 0.76650 0.50000 0.30561 1.00000 Sc2 Sc 0.23350 0.50000 0.69439 1.00000 Sc3 Sc 0.73033 0.00000 0.69382 1.00000 Sc4 Sc 0.26967 0.00000 0.30618 1.00000 Tl1 Tl 0.00000 0.50000 0.00000 1.00000 Tl2 Tl 0.50000 0.00000 0.00000 1.00000 P1 P 0.50000 0.50000 0.50000 1.00000 S1 S 0.00000 0.00000 0.50000 1.00000