# CIF generated by HEAS from Alexandria entry agm005189474 data_agm005189474 _cell_length_a 4.45828 _cell_length_b 4.45828 _cell_length_c 8.69593 _cell_angle_alpha 75.42765 _cell_angle_beta 120.53152 _cell_angle_gamma 119.99132 _cell_volume 128.94274 _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 Pa1 Pa 0.85761 0.20068 0.05829 1.00000 Se1 Se 0.00272 0.86623 0.86894 1.00000 S1 S 0.61148 0.53457 0.14605 1.00000 Br1 Br 0.22032 0.20294 0.42326 1.00000