# CIF generated by HEAS from Alexandria entry agm003376996 data_agm003376996 _cell_length_a 8.88646 _cell_length_b 8.88646 _cell_length_c 8.88646 _cell_angle_alpha 109.47122 _cell_angle_beta 109.47122 _cell_angle_gamma 109.47122 _cell_volume 540.21162 _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 0.00000 0.00000 0.50000 1.00000 Zr2 Zr 0.50000 0.50000 0.50000 1.00000 Zr3 Zr 0.50000 0.00000 0.00000 1.00000 Zr4 Zr 0.00000 0.50000 0.00000 1.00000 Pa1 Pa 0.50000 0.00000 0.50000 1.00000 Pa2 Pa 0.50000 0.50000 0.00000 1.00000 Pa3 Pa 0.00000 0.50000 0.50000 1.00000 Se1 Se 0.69161 0.48811 0.79651 1.00000 Se2 Se 0.30839 0.51189 0.20349 1.00000 Se3 Se 0.30839 0.10490 0.79650 1.00000 Se4 Se 0.48811 0.79651 0.69161 1.00000 Se5 Se 0.79651 0.30839 0.10490 1.00000 Se6 Se 0.20349 0.30839 0.51189 1.00000 Se7 Se 0.10490 0.79651 0.30839 1.00000 Se8 Se 0.20349 0.69161 0.89510 1.00000 Se9 Se 0.69161 0.89510 0.20349 1.00000 Se10 Se 0.51189 0.20349 0.30839 1.00000 Se11 Se 0.79651 0.69161 0.48811 1.00000 Se12 Se 0.89510 0.20349 0.69161 1.00000