# CIF generated by HEAS from Alexandria entry agm001968425 data_agm001968425 _cell_length_a 3.86546 _cell_length_b 3.86546 _cell_length_c 6.86098 _cell_angle_alpha 73.63837 _cell_angle_beta 73.63837 _cell_angle_gamma 60.00000 _cell_volume 83.95264 _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 P1 P 0.00000 0.00000 0.00000 1.00000 Th1 Th 0.23850 0.23850 0.28449 1.00000 Th2 Th 0.76150 0.76150 0.71551 1.00000 N1 N 0.50000 0.50000 0.50000 1.00000