@MOLECULE 4-cyclohexyl-N-(2-hydroxyethyl)-N-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]butanamide 61 61 0 0 0 SMALL GASTEIGER @ATOM 1 C -5.3805 -1.8885 -0.3197 C.3 1 UNL111111111 -0.2771 2 C -6.4198 -2.8847 0.2098 C.3 1 UNL111111111 -0.2639 3 C -7.8323 -2.4663 -0.2192 C.3 1 UNL111111111 -0.2643 4 C -8.1436 -1.0485 0.2785 C.3 1 UNL111111111 -0.2626 5 C -7.1040 -0.0525 -0.2542 C.3 1 UNL111111111 -0.2840 6 C -5.6873 -0.4676 0.1862 C.3 1 UNL111111111 -0.0913 7 C -4.6600 0.5433 -0.3585 C.3 1 UNL111111111 -0.2965 8 C -3.2909 0.3453 0.2973 C.3 1 UNL111111111 -0.2454 9 C -2.2651 1.3405 -0.2630 C.3 1 UNL111111111 -0.3527 10 C -0.8868 0.9577 0.2140 C.2 1 UNL111111111 0.6002 11 O -0.6754 -0.0782 0.8329 O.2 1 UNL111111111 -0.5814 12 N 0.1722 1.8099 -0.0257 N.am 1 UNL111111111 -0.5116 13 C 0.0936 2.9600 -0.9271 C.3 1 UNL111111111 -0.1181 14 C -0.2037 4.2578 -0.1462 C.3 1 UNL111111111 -0.0253 15 O 1.0045 4.8676 0.2510 O.3 1 UNL111111111 -0.5345 16 C 1.4948 1.4630 0.5009 C.3 1 UNL111111111 -0.1252 17 C 2.2492 0.4571 -0.3961 C.3 1 UNL111111111 0.0919 18 H 2.3466 0.8169 -1.4435 H 1 UNL111111111 0.1374 19 C 3.6365 0.1716 0.2320 C.3 1 UNL111111111 0.0451 20 O 3.4611 -0.1456 1.5904 O.3 1 UNL111111111 -0.5444 21 C 4.3781 -0.9652 -0.5002 C.3 1 UNL111111111 0.0825 22 O 3.7529 -2.2026 -0.2238 O.3 1 UNL111111111 -0.5842 23 H -4.3686 -2.1974 0.0016 H 1 UNL111111111 0.1391 24 H -5.3691 -1.9032 -1.4246 H 1 UNL111111111 0.1359 25 H -6.1954 -3.9005 -0.1633 H 1 UNL111111111 0.1310 26 H -6.3604 -2.9434 1.3128 H 1 UNL111111111 0.1367 27 H -7.9202 -2.5075 -1.3203 H 1 UNL111111111 0.1347 28 H -8.5777 -3.1808 0.1732 H 1 UNL111111111 0.1289 29 H -9.1582 -0.7454 -0.0385 H 1 UNL111111111 0.1285 30 H -8.1497 -1.0312 1.3848 H 1 UNL111111111 0.1359 31 H -7.1596 -0.0037 -1.3567 H 1 UNL111111111 0.1360 32 H -7.3350 0.9627 0.1124 H 1 UNL111111111 0.1280 33 H -5.6441 -0.4648 1.3013 H 1 UNL111111111 0.1362 34 H -4.5830 0.4427 -1.4572 H 1 UNL111111111 0.1380 35 H -5.0166 1.5737 -0.1733 H 1 UNL111111111 0.1347 36 H -3.3605 0.4502 1.3975 H 1 UNL111111111 0.1518 37 H -2.9326 -0.6932 0.1316 H 1 UNL111111111 0.1650 38 H -2.2959 1.3210 -1.3734 H 1 UNL111111111 0.1676 39 H -2.5257 2.3713 0.0417 H 1 UNL111111111 0.1630 40 H 1.0609 3.0846 -1.4750 H 1 UNL111111111 0.1693 41 H -0.6761 2.7970 -1.7121 H 1 UNL111111111 0.1449 42 H -0.6661 5.0253 -0.7958 H 1 UNL111111111 0.1454 43 H -0.8478 4.0844 0.7326 H 1 UNL111111111 0.1279 44 H 1.3856 4.4064 1.0257 H 1 UNL111111111 0.3150 45 H 2.0997 2.3867 0.6362 H 1 UNL111111111 0.1523 46 H 1.3729 1.0182 1.5252 H 1 UNL111111111 0.1906 47 O 1.5466 -0.7595 -0.5114 O.3 1 UNL111111111 -0.6204 48 H 4.2617 1.0967 0.2566 H 1 UNL111111111 0.1663 49 H 3.1889 -1.0887 1.6839 H 1 UNL111111111 0.3373 50 H 4.3886 -0.8000 -1.6003 H 1 UNL111111111 0.1424 51 C 5.8123 -1.1097 0.0513 C.3 1 UNL111111111 0.1177 52 H 2.7757 -2.0888 -0.3816 H 1 UNL111111111 0.3601 53 C 6.4268 -2.4478 -0.3803 C.3 1 UNL111111111 -0.0503 54 O 7.7273 -2.4307 0.1940 O.3 1 UNL111111111 -0.5728 55 H 5.8561 -0.9794 1.1557 H 1 UNL111111111 0.1535 56 O 6.5144 -0.0338 -0.5455 O.3 1 UNL111111111 -0.5794 57 H 0.7640 -0.7833 0.1004 H 1 UNL111111111 0.3786 58 H 5.8440 -3.3024 0.0090 H 1 UNL111111111 0.1442 59 H 6.5291 -2.5247 -1.4759 H 1 UNL111111111 0.1303 60 H 8.1216 -3.3193 0.1646 H 1 UNL111111111 0.3201 61 H 7.4787 -0.1607 -0.4143 H 1 UNL111111111 0.3417 @BOND 1 1 2 1 2 1 23 1 3 1 24 1 4 2 25 1 5 2 26 1 6 3 2 1 7 3 27 1 8 3 28 1 9 4 3 1 10 4 29 1 11 4 30 1 12 5 6 1 13 5 4 1 14 5 31 1 15 5 32 1 16 6 1 1 17 6 33 1 18 7 8 1 19 7 6 1 20 7 34 1 21 7 35 1 22 8 36 1 23 8 37 1 24 9 8 1 25 9 38 1 26 9 39 1 27 10 9 1 28 10 11 2 29 12 10 am 30 13 12 1 31 13 14 1 32 13 40 1 33 13 41 1 34 14 42 1 35 14 43 1 36 15 14 1 37 15 44 1 38 16 12 1 39 16 45 1 40 16 46 1 41 17 16 1 42 17 47 1 43 18 17 1 44 19 17 1 45 19 48 1 46 20 19 1 47 20 49 1 48 21 19 1 49 21 50 1 50 21 51 1 51 22 21 1 52 22 52 1 53 47 57 1 54 51 53 1 55 51 55 1 56 51 56 1 57 53 54 1 58 53 58 1 59 53 59 1 60 54 60 1 61 56 61 1