@MOLECULE (2s,3r,4s,5r)-3,4,5-trihydroxy-6-oxotetrahydro-2h-pyran-2-carboxylic acid 21 21 0 0 0 SMALL GASTEIGER @ATOM 1 C 0.9364 -1.3558 0.2278 C.2 1 UNL1111111111 0.5435 2 O 1.5160 -2.4016 0.1760 O.2 1 UNL1111111111 -0.3999 3 C 1.3509 -0.0731 -0.4619 C.3 1 UNL1111111111 -0.0190 4 O 2.7365 -0.0654 -0.7056 O.3 1 UNL1111111111 -0.5416 5 C 1.1061 1.1038 0.5010 C.3 1 UNL1111111111 0.0812 6 O 1.4088 2.3261 -0.1326 O.3 1 UNL1111111111 -0.5568 7 C -0.3920 1.1923 0.8748 C.3 1 UNL1111111111 0.0839 8 O -1.1397 1.9051 -0.0821 O.3 1 UNL1111111111 -0.5453 9 C -1.0558 -0.2065 0.9127 C.3 1 UNL1111111111 0.0102 10 O -0.1542 -1.2784 1.0619 O.3 1 UNL1111111111 -0.3900 11 C -1.8367 -0.4283 -0.3793 C.2 1 UNL1111111111 0.6355 12 O -1.3770 -0.7092 -1.4535 O.2 1 UNL1111111111 -0.5102 13 O -3.1592 -0.3204 -0.1502 O.3 1 UNL1111111111 -0.5265 14 H 0.8215 0.0578 -1.4414 H 1 UNL1111111111 0.1992 15 H 3.0549 -0.9651 -0.9630 H 1 UNL1111111111 0.3505 16 H 1.7556 1.0233 1.4040 H 1 UNL1111111111 0.1565 17 H 2.2497 2.2381 -0.6439 H 1 UNL1111111111 0.3561 18 H -0.5246 1.7317 1.8413 H 1 UNL1111111111 0.1562 19 H -0.5544 2.5253 -0.5862 H 1 UNL1111111111 0.3586 20 H -1.7096 -0.3335 1.8136 H 1 UNL1111111111 0.1972 21 H -3.7135 -0.4140 -0.9690 H 1 UNL1111111111 0.3608 @BOND 1 1 2 2 2 1 3 1 3 1 10 1 4 3 4 1 5 3 5 1 6 3 14 1 7 4 15 1 8 5 6 1 9 5 7 1 10 5 16 1 11 6 17 1 12 7 8 1 13 7 9 1 14 7 18 1 15 8 19 1 16 9 10 1 17 9 11 1 18 9 20 1 19 11 12 2 20 11 13 1 21 13 21 1