# CIF generated by HEAS from Alexandria entry agm005696944 data_agm005696944 _cell_length_a 7.87679 _cell_length_b 7.95522 _cell_length_c 8.53033 _cell_angle_alpha 76.78706 _cell_angle_beta 62.50357 _cell_angle_gamma 60.32560 _cell_volume 411.96101 _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 0.57451 0.85097 0.50000 1.00000 Pa2 Pa 0.17549 0.64903 0.00000 1.00000 Pa3 Pa 0.92549 0.14903 0.50000 1.00000 Pa4 Pa 0.82451 0.35097 1.00000 1.00000 H1 H 0.24710 0.74375 0.17243 1.00000 H2 H 0.16328 0.25625 0.82757 1.00000 H3 H 0.00915 0.74375 0.82757 1.00000 H4 H 0.58047 0.25625 0.17243 1.00000 H5 H 0.50290 0.75625 0.32757 1.00000 H6 H 0.58672 0.24375 0.67243 1.00000 H7 H 0.74085 0.75625 0.67243 1.00000 H8 H 0.43123 0.13753 0.50000 1.00000 H9 H 0.68123 0.63753 1.00000 1.00000 H10 H 0.31877 0.36247 0.00000 1.00000 H11 H 0.06877 0.86247 0.50000 1.00000 H12 H 0.16953 0.24375 0.32757 1.00000 Se1 Se 0.87099 0.50000 0.25801 1.00000 Se2 Se 0.12099 1.00000 0.75801 1.00000 Se3 Se 0.87901 0.00000 0.24199 1.00000 Se4 Se 0.62901 0.50000 0.74199 1.00000 Se5 Se 0.35843 0.00000 0.28315 1.00000 Se6 Se 0.64157 1.00000 0.71685 1.00000 Se7 Se 0.39157 0.50000 0.21685 1.00000 Se8 Se 0.10843 0.50000 0.78315 1.00000