@MOLECULE (2r,6s)-6-[(1r)-1,2-dihydroxyethyl]-2-hydroxy-5,6-dihydro-2h-pyran-2-carboxylic acid 26 26 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.3943 0.1898 -1.6957 O.3 1 UNL1111111111 -0.5611 2 C 1.3868 -0.0760 -0.3116 C.3 1 UNL1111111111 0.4430 3 C 2.3167 0.9401 0.3814 C.2 1 UNL1111111111 0.5801 4 O 2.0906 1.7574 1.2222 O.2 1 UNL1111111111 -0.4401 5 O 3.5663 0.7638 -0.1309 O.3 1 UNL1111111111 -0.5865 6 C 1.7777 -1.4925 -0.0205 C.2 1 UNL1111111111 -0.3163 7 C 0.8592 -2.3864 0.3570 C.2 1 UNL1111111111 -0.0420 8 C -0.5757 -2.0199 0.5244 C.3 1 UNL1111111111 -0.3416 9 C -0.8821 -0.7049 -0.1995 C.3 1 UNL1111111111 0.1022 10 O 0.1090 0.2689 0.1400 O.3 1 UNL1111111111 -0.3867 11 C -2.1841 -0.0550 0.3112 C.3 1 UNL1111111111 0.0766 12 O -3.1841 -1.0239 0.0615 O.3 1 UNL1111111111 -0.5649 13 C -2.4811 1.2430 -0.4525 C.3 1 UNL1111111111 -0.0573 14 O -3.7176 1.7553 -0.0010 O.3 1 UNL1111111111 -0.5484 15 H 2.2530 -0.0615 -2.1014 H 1 UNL1111111111 0.3433 16 H 4.2427 1.3844 0.2349 H 1 UNL1111111111 0.3621 17 H 2.8300 -1.7282 -0.1480 H 1 UNL1111111111 0.1743 18 H 1.1132 -3.4233 0.5778 H 1 UNL1111111111 0.1486 19 H -1.2566 -2.8135 0.1475 H 1 UNL1111111111 0.1792 20 H -0.8121 -1.9348 1.6091 H 1 UNL1111111111 0.1766 21 H -0.8961 -0.8392 -1.3040 H 1 UNL1111111111 0.1547 22 H -2.1557 0.1141 1.4105 H 1 UNL1111111111 0.1385 23 H -4.0515 -0.5748 -0.0681 H 1 UNL1111111111 0.3420 24 H -1.6740 1.9887 -0.3355 H 1 UNL1111111111 0.1497 25 H -2.6611 1.0630 -1.5299 H 1 UNL1111111111 0.1576 26 H -3.6272 2.1514 0.8889 H 1 UNL1111111111 0.3166 @BOND 1 1 2 1 2 1 15 1 3 2 3 1 4 2 6 1 5 2 10 1 6 3 5 1 7 4 3 2 8 5 16 1 9 6 7 2 10 6 17 1 11 7 8 1 12 7 18 1 13 8 19 1 14 8 20 1 15 9 8 1 16 9 11 1 17 9 21 1 18 10 9 1 19 11 13 1 20 11 12 1 21 11 22 1 22 12 23 1 23 13 24 1 24 13 25 1 25 14 13 1 26 14 26 1