@MOLECULE FDBD01949 7 7 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0173 1.4248 0.0099 C.3 1 UNK 0.0711 2 C1 1.2859 0.6234 -0.0069 C.3 1 UNK 0.0711 3 O 0.0021 -0.0041 0.0020 O.3 1 UNK -0.3752 4 H -0.3140 1.9572 0.8893 H 1 UNK 0.0583 5 H1 -0.4571 2.1921 -0.5924 H 1 UNK 0.0583 6 H2 1.9113 0.5888 0.8606 H 1 UNK 0.0583 7 H3 2.1577 0.5842 -0.6261 H 1 UNK 0.0583 @BOND 1 1 3 1 2 1 2 1 3 2 3 1 4 1 4 1 5 1 5 1 6 2 6 1 7 2 7 1