@MOLECULE (2s,3r,4s,5r,6r)-2-ethoxy-6-(hydroxymethyl)-2-methoxy-3-(3-methyl-3h-diaziren-3-yl)tetrahydro-2h-pyran-3,4,5-triol 40 41 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.7697 -0.5556 1.4376 O.3 1 UNL1111111111 -0.4995 2 O 1.0835 1.6352 1.4492 O.3 1 UNL1111111111 -0.5122 3 O 0.2331 -1.2262 -0.5435 O.3 1 UNL1111111111 -0.5039 4 O 1.4175 -1.1561 1.3966 O.3 1 UNL1111111111 -0.4002 5 O -0.6341 1.0583 -1.7048 O.3 1 UNL1111111111 -0.5356 6 O -2.7286 2.0980 -0.1345 O.3 1 UNL1111111111 -0.5150 7 O -3.8315 -0.3796 -0.4112 O.3 1 UNL1111111111 -0.5555 8 N 2.3747 -0.0376 -1.6066 N.2 1 UNL1111111111 -0.0860 9 N 3.0698 -0.1393 -0.5845 N.2 1 UNL1111111111 -0.0660 10 C 0.8125 0.9099 0.2728 C.3 1 UNL1111111111 0.1496 11 C 2.0822 0.9997 -0.5543 C.3 1 UNL1111111111 0.0452 12 C -0.3836 1.6027 -0.4399 C.3 1 UNL1111111111 0.0660 13 C 0.4030 -0.5549 0.6593 C.3 1 UNL1111111111 0.5592 14 C -1.6283 1.4911 0.4713 C.3 1 UNL1111111111 0.0583 15 C -1.9293 0.0352 0.8803 C.3 1 UNL1111111111 0.0742 16 C 2.6054 2.3908 -0.7563 C.3 1 UNL1111111111 -0.4372 17 C -2.4966 -0.8425 -0.2475 C.3 1 UNL1111111111 -0.0464 18 C 0.3183 -2.6550 -0.5139 C.3 1 UNL1111111111 0.0259 19 C 1.1492 -1.4410 2.7599 C.3 1 UNL1111111111 -0.1596 20 C -0.0122 -3.0645 -1.9403 C.3 1 UNL1111111111 -0.4644 21 H -0.1678 2.6771 -0.6545 H 1 UNL1111111111 0.1751 22 H -1.4725 2.1261 1.3809 H 1 UNL1111111111 0.1548 23 H -2.6293 0.0138 1.7550 H 1 UNL1111111111 0.1711 24 H 3.6583 2.4056 -1.0718 H 1 UNL1111111111 0.1652 25 H 2.0244 2.9280 -1.5243 H 1 UNL1111111111 0.1738 26 H 2.5484 2.9730 0.1805 H 1 UNL1111111111 0.1864 27 H 0.5418 1.2953 2.1988 H 1 UNL1111111111 0.3298 28 H -2.5073 -1.9053 0.0517 H 1 UNL1111111111 0.1295 29 H -1.9595 -0.7284 -1.2060 H 1 UNL1111111111 0.1491 30 H -0.2537 0.1547 -1.7843 H 1 UNL1111111111 0.3376 31 H -3.1785 1.4733 -0.7538 H 1 UNL1111111111 0.3444 32 H 1.3500 -2.9309 -0.2244 H 1 UNL1111111111 0.1428 33 H -0.3968 -3.0387 0.2315 H 1 UNL1111111111 0.1217 34 H 2.0734 -1.9477 3.0715 H 1 UNL1111111111 0.1523 35 H 0.2832 -2.1019 2.8727 H 1 UNL1111111111 0.1384 36 H 1.0132 -0.5121 3.3196 H 1 UNL1111111111 0.1283 37 H -4.2725 -0.8694 -1.1318 H 1 UNL1111111111 0.3211 38 H 0.1800 -4.1323 -2.0977 H 1 UNL1111111111 0.1582 39 H -1.0581 -2.8640 -2.1954 H 1 UNL1111111111 0.1494 40 H 0.6107 -2.5077 -2.6590 H 1 UNL1111111111 0.1743 @BOND 1 1 13 1 2 1 15 1 3 2 10 1 4 2 27 1 5 3 13 1 6 3 18 1 7 4 13 1 8 4 19 1 9 5 12 1 10 5 30 1 11 6 14 1 12 6 31 1 13 7 17 1 14 7 37 1 15 8 9 2 16 8 11 1 17 9 11 1 18 10 11 1 19 10 12 1 20 10 13 1 21 11 16 1 22 12 14 1 23 12 21 1 24 14 15 1 25 14 22 1 26 15 17 1 27 15 23 1 28 16 24 1 29 16 25 1 30 16 26 1 31 17 28 1 32 17 29 1 33 18 20 1 34 18 32 1 35 18 33 1 36 19 34 1 37 19 35 1 38 19 36 1 39 20 38 1 40 20 39 1 41 20 40 1