# CIF generated by HEAS from Alexandria entry agm005198345 data_agm005198345 _cell_length_a 3.66052 _cell_length_b 3.65630 _cell_length_c 6.92937 _cell_angle_alpha 90.00389 _cell_angle_beta 105.39170 _cell_angle_gamma 119.96064 _cell_volume 76.48448 _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 0.48710 0.14152 0.64352 1.00000 Sc1 Sc 0.11909 0.95751 0.09248 1.00000 Se1 Se 0.96544 0.38068 0.36087 1.00000 S1 S 0.30627 0.55109 0.87279 1.00000