@MOLECULE 2-hydroxyethyl methanesulfonate 16 15 0 0 0 SMALL GASTEIGER @ATOM 1 S -1.2039 0.0209 0.1149 S.O2 1 UNL1111111111 2.3858 2 O 0.3305 -0.1196 -0.5161 O.3 1 UNL1111111111 -0.7564 3 O 3.1168 0.7456 0.2540 O.3 1 UNL1111111111 -0.5466 4 O -1.1094 0.8747 1.2687 O.2 1 UNL1111111111 -0.8942 5 O -1.7440 -1.3067 0.2368 O.2 1 UNL1111111111 -0.8974 6 C 1.3219 -0.8744 0.1533 C.3 1 UNL1111111111 0.0050 7 C 2.6435 -0.3827 -0.4493 C.3 1 UNL1111111111 -0.0202 8 C -1.9239 0.8774 -1.2441 C.3 1 UNL1111111111 -0.7454 9 H 1.2876 -0.6859 1.2446 H 1 UNL1111111111 0.1438 10 H 1.1348 -1.9445 -0.0575 H 1 UNL1111111111 0.1349 11 H 2.5273 -0.1180 -1.5171 H 1 UNL1111111111 0.1346 12 H 3.4570 -1.1210 -0.3305 H 1 UNL1111111111 0.1425 13 H -3.0025 0.6797 -1.3310 H 1 UNL1111111111 0.1945 14 H -1.8017 1.9675 -1.1589 H 1 UNL1111111111 0.1966 15 H -1.4726 0.5824 -2.2041 H 1 UNL1111111111 0.1972 16 H 2.4073 1.4209 0.3165 H 1 UNL1111111111 0.3253 @BOND 1 1 2 1 2 1 4 2 3 1 5 2 4 1 8 1 5 2 6 1 6 3 7 1 7 3 16 1 8 6 7 1 9 6 9 1 10 6 10 1 11 7 11 1 12 7 12 1 13 8 13 1 14 8 14 1 15 8 15 1