@MOLECULE 2-methoxy-5-hydroxymethylcyclopentane-1,3,4-triol 26 26 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.1356 -0.6196 -0.9022 O.3 1 UNL1111111111 -0.4014 2 O -0.1917 -2.3109 1.0480 O.3 1 UNL1111111111 -0.5624 3 O 1.4918 1.8249 -0.3703 O.3 1 UNL1111111111 -0.5832 4 O -1.4076 1.9071 0.9621 O.3 1 UNL1111111111 -0.5645 5 O 3.4155 -0.0619 -0.4218 O.3 1 UNL1111111111 -0.5613 6 C 1.1780 -0.5270 0.3738 C.3 1 UNL1111111111 -0.2611 7 C -0.1154 -1.3056 0.0598 C.3 1 UNL1111111111 0.1262 8 C 0.7873 0.9674 0.4904 C.3 1 UNL1111111111 0.1053 9 C -1.2993 -0.3199 0.1956 C.3 1 UNL1111111111 0.0183 10 C -0.6943 1.0887 0.0617 C.3 1 UNL1111111111 0.0748 11 C 2.2328 -0.7920 -0.7014 C.3 1 UNL1111111111 0.0025 12 C -3.4136 -0.0128 -0.8189 C.3 1 UNL1111111111 -0.1897 13 H 1.5657 -0.8807 1.3632 H 1 UNL1111111111 0.1776 14 H -0.1111 -1.7908 -0.9416 H 1 UNL1111111111 0.1414 15 H 0.9412 1.3467 1.5248 H 1 UNL1111111111 0.1371 16 H -1.8427 -0.4411 1.1569 H 1 UNL1111111111 0.1604 17 H -0.7934 1.4998 -0.9665 H 1 UNL1111111111 0.1585 18 H 1.9359 -0.4012 -1.6962 H 1 UNL1111111111 0.1573 19 H 2.4795 -1.8660 -0.7813 H 1 UNL1111111111 0.1287 20 H -1.0032 -2.8461 0.9359 H 1 UNL1111111111 0.3258 21 H 2.4279 1.5340 -0.4680 H 1 UNL1111111111 0.3558 22 H -1.0485 2.8187 0.9497 H 1 UNL1111111111 0.3282 23 H 3.8086 -0.3407 0.4284 H 1 UNL1111111111 0.3213 24 H -3.3323 1.0672 -0.6494 H 1 UNL1111111111 0.1398 25 H -4.0035 -0.4822 -0.0258 H 1 UNL1111111111 0.1223 26 H -3.8512 -0.2184 -1.8032 H 1 UNL1111111111 0.1425 @BOND 1 1 9 1 2 1 12 1 3 2 7 1 4 2 20 1 5 3 8 1 6 3 21 1 7 4 10 1 8 4 22 1 9 5 11 1 10 5 23 1 11 6 7 1 12 6 8 1 13 6 11 1 14 6 13 1 15 7 9 1 16 7 14 1 17 8 10 1 18 8 15 1 19 9 10 1 20 9 16 1 21 10 17 1 22 11 18 1 23 11 19 1 24 12 24 1 25 12 25 1 26 12 26 1