@MOLECULE s-(hydroxymethyl)-l-cysteine 18 17 0 0 0 SMALL GASTEIGER @ATOM 1 O1 2.6259 0.6539 1.1679 O.2 1 <1> -0.4926 2 O2 2.7619 0.9774 -1.0385 O.3 1 <1> -0.5529 3 C1 2.2284 0.4020 0.0644 C.2 1 <1> 0.6262 4 C2 1.0750 -0.5186 -0.3344 C.3 1 <1> 0.0072 5 N1 1.3956 -1.8228 0.2540 N.3 1 <1> -0.6331 6 C3 -0.2059 0.1561 0.1787 C.3 1 <1> -0.3819 7 S1 -1.6697 -0.8024 -0.3636 S.3 1 <1> -0.0987 8 C4 -3.0432 0.1387 0.4500 C.3 1 <1> -0.0238 9 O3 -3.0566 1.4750 0.0554 O.3 1 <1> -0.5192 10 H1 3.5283 1.5742 -0.8472 H 1 <1> 0.3569 11 H2 1.0555 -0.6314 -1.4569 H 1 <1> 0.1892 12 H3 1.3974 -1.8070 1.2633 H 1 <1> 0.2679 13 H4 0.7927 -2.5592 -0.0753 H 1 <1> 0.2698 14 H5 -0.1916 0.2440 1.2825 H 1 <1> 0.1763 15 H6 -0.2892 1.1932 -0.2057 H 1 <1> 0.1838 16 H7 -3.9893 -0.3718 0.2016 H 1 <1> 0.1390 17 H8 -2.9043 0.1955 1.5463 H 1 <1> 0.1610 18 H9 -3.3346 1.5817 -0.8815 H 1 <1> 0.3249 @BOND 1 1 3 2 2 2 3 1 3 2 10 1 4 3 4 1 5 4 5 1 6 4 6 1 7 4 11 1 8 5 12 1 9 5 13 1 10 6 7 1 11 6 14 1 12 6 15 1 13 7 8 1 14 8 9 1 15 8 16 1 16 8 17 1 17 9 18 1