# CIF generated by HEAS from Alexandria entry agm004886540 data_agm004886540 _cell_length_a 5.22808 _cell_length_b 5.22808 _cell_length_c 6.79130 _cell_angle_alpha 112.63817 _cell_angle_beta 112.63817 _cell_angle_gamma 90.00000 _cell_volume 155.71416 _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 La1 La 0.75000 0.25000 0.50000 1.00000 Pa1 Pa 0.00000 0.00000 0.00000 1.00000 Ti1 Ti 0.50000 0.50000 0.00000 1.00000 Ti2 Ti 0.25000 0.75000 0.50000 1.00000 O1 O 0.75273 0.83631 0.15198 1.00000 O2 O 0.39925 0.31566 0.15198 1.00000 O3 O 0.59470 0.68734 0.67838 1.00000 O4 O 0.08368 0.99104 0.67838 1.00000 O5 O 0.00896 0.40530 0.32162 1.00000 O6 O 0.31266 0.91632 0.32162 1.00000 O7 O 0.16369 0.60075 0.84802 1.00000 O8 O 0.68434 0.24727 0.84802 1.00000