@MOLECULE DB02646 9 8 1 SMALL USER_CHARGES @ATOM 1 O1 1.9575 1.0089 0.0000 O.2 1 noname -0.1894 2 N1 1.3750 0.0000 0.0000 N.2 1 noname -0.0314 3 C1 0.0000 0.0000 0.0000 C.3 1 noname 0.0783 4 C2 -0.5100 -1.4425 0.0000 C.3 1 noname -0.0421 5 H1 -0.2803 0.4674 0.9440 H 1 noname 0.0548 6 H2 -0.2803 0.4674 -0.9440 H 1 noname 0.0548 7 H3 -0.6311 -1.7851 1.0277 H 1 noname 0.0250 8 H4 -1.4702 -1.4884 -0.5138 H 1 noname 0.0250 9 H5 0.2080 -2.0817 -0.5138 H 1 noname 0.0250 @BOND 1 1 2 2 2 2 3 1 3 3 4 1 4 3 5 1 5 3 6 1 6 4 7 1 7 4 8 1 8 4 9 1 @SUBSTRUCTURE 1 noname 1