# CIF generated by HEAS from Alexandria entry agm005122003 data_agm005122003 _cell_length_a 3.29298 _cell_length_b 3.29298 _cell_length_c 6.08630 _cell_angle_alpha 74.30453 _cell_angle_beta 74.30453 _cell_angle_gamma 60.00000 _cell_volume 54.29604 _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 0.67227 0.67227 0.98317 1.00000 Pa1 Pa 0.49777 0.49777 0.50669 1.00000 N1 N 0.07633 0.07633 0.77102 1.00000 N2 N 0.25363 0.25363 0.23912 1.00000