@MOLECULE Default_Mol 8 7 1 0 1 SMALL USER_CHARGES @ATOM 1 H1 1.224828 -1.752340 0.238570 H 1 UNK 0.3643 **** 2 N2 1.432738 -0.754979 0.226757 N 1 UNK -1.0320 **** 3 P3 -0.041639 0.161865 0.100916 P 1 UNK 1.3380 **** 4 O4 -0.914132 -0.154596 1.290337 O 1 UNK -0.8432 **** 5 O5 0.347318 1.545017 -0.335300 O 1 UNK -0.8089 **** 6 O6 -0.805960 -0.633058 -1.198145 O 1 UNK -0.7866 **** 7 H7 -1.656424 -0.880263 -0.802502 H 1 UNK 0.4042 **** 8 H8 2.009206 -0.569423 -0.592244 H 1 UNK 0.3643 **** @BOND 1 1 2 1 2 2 8 1 3 2 3 1 4 3 6 1 5 3 4 1 6 3 5 1 7 6 7 1 @SUBSTRUCTURE 1 UNK 1 **** 0 **** ****