# CIF generated by HEAS from Alexandria entry agm002000523 data_agm002000523 _cell_length_a 3.45157 _cell_length_b 3.45157 _cell_length_c 9.57344 _cell_angle_alpha 79.61465 _cell_angle_beta 79.61465 _cell_angle_gamma 60.00000 _cell_volume 96.60787 _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 B1 B 0.50000 0.50000 0.50000 1.00000 Pa1 Pa 0.11363 0.11363 0.65911 1.00000 Pa2 Pa 0.88637 0.88637 0.34089 1.00000 La1 La 0.00000 0.00000 0.00000 1.00000