@MOLECULE dimethyl-[(2R)-2-methylbutanoyl]sulfonium 24 23 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.4949 -0.7620 -0.6950 C.3 1 UNL111 -0.4358 2 C 2.3420 0.2394 -0.6853 C.3 1 UNL111 -0.2513 3 C 1.2293 -0.1942 0.2879 C.3 1 UNL111 -0.1821 4 H 1.0691 -1.2959 0.1869 H 1 UNL111 0.1619 5 C 1.5910 0.1312 1.7397 C.3 1 UNL111 -0.4334 6 C -0.0324 0.5676 -0.0528 C.2 1 UNL111 0.5847 7 O -0.0541 1.6846 -0.4849 O.2 1 UNL111 -0.4803 8 S -1.5682 -0.2839 0.3087 S.3 1 UNL111 -0.4306 9 C -2.0400 -1.8891 -0.4098 C.3 1 UNL111 -0.2899 10 C -2.8661 0.8770 -0.3157 C.3 1 UNL111 -0.3078 11 H 3.9226 -0.8983 0.3045 H 1 UNL111 0.1433 12 H 3.1726 -1.7456 -1.0540 H 1 UNL111 0.1408 13 H 4.3040 -0.4236 -1.3524 H 1 UNL111 0.1427 14 H 2.7061 1.2501 -0.4124 H 1 UNL111 0.1533 15 H 1.9306 0.3480 -1.7087 H 1 UNL111 0.1429 16 H 0.8250 -0.2332 2.4374 H 1 UNL111 0.1598 17 H 2.5416 -0.3362 2.0218 H 1 UNL111 0.1502 18 H 1.6944 1.2124 1.8994 H 1 UNL111 0.1553 19 H -2.0029 -1.8642 -1.5011 H 1 UNL111 0.1330 20 H -1.3432 -2.6445 -0.0310 H 1 UNL111 0.1464 21 H -3.0529 -2.1350 -0.0752 H 1 UNL111 0.1461 22 H -3.7960 0.6697 0.2180 H 1 UNL111 0.1463 23 H -2.5370 1.9021 -0.1033 H 1 UNL111 0.1664 24 H -3.0097 0.7596 -1.3917 H 1 UNL111 0.1382 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 3 5 1 5 3 6 1 6 6 7 2 7 6 8 1 8 8 9 1 9 8 10 1 10 1 11 1 11 1 12 1 12 1 13 1 13 2 14 1 14 2 15 1 15 5 16 1 16 5 17 1 17 5 18 1 18 9 19 1 19 9 20 1 20 9 21 1 21 10 22 1 22 10 23 1 23 10 24 1