@MOLECULE (1r)-1,4-anhydro-1-{4-[(z)-imino(methoxy)methyl]-1,3-thiazol-2-yl}-d-ribitol 32 33 0 0 0 SMALL GASTEIGER @ATOM 1 S 0.7937 -2.3829 -1.1801 S.2 1 UNL1111 0.2617 2 O -1.9676 -0.1466 -1.1463 O.3 1 UNL1111 -0.3965 3 O -4.0101 0.8951 1.1641 O.3 1 UNL1111 -0.5378 4 O -3.0378 -1.4270 1.6268 O.3 1 UNL1111 -0.5513 5 O -1.0508 2.3318 -2.2023 O.3 1 UNL1111 -0.5318 6 O 3.0046 1.4732 0.1451 O.2 1 UNL1111 -0.3630 7 N 0.7697 -0.3329 0.3942 N.ar 1 UNL1111 -0.3492 8 N 4.0087 -0.1918 1.5337 N.2 1 UNL1111 -0.6031 9 C -2.6326 0.8789 0.9101 C.3 1 UNL1111 0.0612 10 C -2.0366 -0.5241 1.2216 C.3 1 UNL1111 0.0667 11 C -2.3326 1.1104 -0.5801 C.3 1 UNL1111 0.0039 12 C -1.5410 -1.0569 -0.1427 C.3 1 UNL1111 0.0814 13 C -1.1939 2.1090 -0.8169 C.3 1 UNL1111 -0.0474 14 C -0.0530 -1.1592 -0.2129 C.ar 1 UNL1111 0.0085 15 C 2.1015 -0.6329 0.1151 C.ar 1 UNL1111 0.0869 16 C 2.3128 -1.7105 -0.7072 C.ar 1 UNL1111 -0.3040 17 C 3.1466 0.2311 0.6998 C.2 1 UNL1111 0.4352 18 C 3.8759 2.4982 0.5906 C.3 1 UNL1111 -0.2020 19 H -2.2458 1.6756 1.5781 H 1 UNL1111 0.1633 20 H -1.2503 -0.4957 2.0037 H 1 UNL1111 0.1595 21 H -3.2386 1.3966 -1.1621 H 1 UNL1111 0.1692 22 H -2.0585 -2.0138 -0.4076 H 1 UNL1111 0.1806 23 H -0.2305 1.7603 -0.3993 H 1 UNL1111 0.1526 24 H -1.4307 3.1120 -0.4165 H 1 UNL1111 0.1484 25 H -4.4741 0.2095 0.6275 H 1 UNL1111 0.3315 26 H -3.5693 -1.0437 2.3620 H 1 UNL1111 0.3364 27 H -0.8608 1.4803 -2.6536 H 1 UNL1111 0.3211 28 H 3.2652 -2.1062 -1.0199 H 1 UNL1111 0.2016 29 H 4.7227 0.3849 1.9336 H 1 UNL1111 0.2865 30 H 3.5558 3.3550 -0.0217 H 1 UNL1111 0.1651 31 H 4.9200 2.2512 0.3784 H 1 UNL1111 0.1306 32 H 3.7151 2.7098 1.6520 H 1 UNL1111 0.1341 @BOND 1 1 14 ar 2 1 16 ar 3 2 11 1 4 2 12 1 5 3 9 1 6 3 25 1 7 4 10 1 8 4 26 1 9 5 13 1 10 5 27 1 11 6 17 1 12 6 18 1 13 7 14 ar 14 7 15 ar 15 8 17 2 16 8 29 1 17 9 10 1 18 9 11 1 19 9 19 1 20 10 12 1 21 10 20 1 22 11 13 1 23 11 21 1 24 12 14 1 25 12 22 1 26 13 23 1 27 13 24 1 28 15 16 ar 29 15 17 1 30 16 28 1 31 18 30 1 32 18 31 1 33 18 32 1