@MOLECULE ethanimidoylcarbamodithioic acid 12 11 0 0 0 SMALL USER_CHARGES @ATOM 1 S1 2.0161 -1.1658 0.0010 S.2 1 CHGB1111 0.1245 2 S2 1.0382 1.5625 -0.0045 S.3 1 CHGB1111 -0.4213 3 N1 -0.5147 -0.6977 0.0056 N.am 1 CHGB1111 -0.5979 4 N2 -2.0992 1.1171 0.0073 N.pl3 1 CHGB1111 -0.5986 5 C1 0.6728 -0.0565 0.0018 C.2 1 CHGB1111 0.2381 6 C2 -1.7428 -0.1974 0.0046 C.2 1 CHGB1111 0.5270 7 C3 -2.8644 -1.1958 -0.0090 C.3 1 CHGB1111 -0.4796 8 H1 -3.0588 1.4021 0.0040 H 1 CHGB1111 0.3076 9 H2 -1.4162 1.8649 0.0102 H 1 CHGB1111 0.3417 10 H3 -2.4780 -2.2268 0.1166 H 1 CHGB1111 0.2038 11 H4 -3.4034 -1.1822 -0.9688 H 1 CHGB1111 0.1801 12 H5 -3.5872 -1.0270 0.8009 H 1 CHGB1111 0.1747 @BOND 1 1 5 2 2 2 5 1 3 3 5 1 4 3 6 2 5 4 6 1 6 4 8 1 7 4 9 1 8 6 7 1 9 7 10 1 10 7 11 1 11 7 12 1