@MOLECULE n-(2-{[5-(5-chloro-2-thienyl)-1,2-oxazol-3-yl]methoxy}-6-[3-(beta-d-glucopyranosyloxy)propoxy]phenyl)-1-isopropyl-4-piperidinecarboxamide 89 93 0 0 0 SMALL GASTEIGER @ATOM 1 C 8.1893 -1.8297 -1.2381 C.ar 1 UNL111111111 -0.1585 2 C 9.1110 -0.8210 -1.2374 C.ar 1 UNL111111111 -0.1916 3 C 8.5253 0.4463 -0.9342 C.ar 1 UNL111111111 -0.1164 4 C 7.1704 0.3808 -0.7097 C.ar 1 UNL111111111 -0.2172 5 O 6.8610 2.7302 -0.5326 O.2 1 UNL111111111 0.0504 6 C 6.3027 1.4611 -0.3928 C.ar 1 UNL111111111 0.0842 7 O -0.4631 -0.0290 0.9029 O.2 1 UNL111111111 -0.5438 8 C 0.3372 -0.1039 -0.0046 C.2 1 UNL111111111 0.5909 9 C 0.9140 -1.4146 -0.5230 C.3 1 UNL111111111 -0.1874 10 C 2.4401 -1.4509 -0.3837 C.3 1 UNL111111111 -0.2704 11 C 2.8469 -1.4112 1.1009 C.3 1 UNL111111111 -0.1093 12 N 2.3042 -2.6094 1.7947 N.3 1 UNL111111111 -0.4473 13 C 2.7836 -2.6587 3.2121 C.3 1 UNL111111111 0.0856 14 C 2.2179 -3.9076 3.9133 C.3 1 UNL111111111 -0.4692 15 C 4.3222 -2.7475 3.2325 C.3 1 UNL111111111 -0.4622 16 C 0.8185 -2.5873 1.7342 C.3 1 UNL111111111 -0.1197 17 C 0.3319 -2.5910 0.2717 C.3 1 UNL111111111 -0.2633 18 N 0.7502 1.0394 -0.6777 N.am 1 UNL111111111 -0.5465 19 C 0.3120 2.3087 -0.2301 C.ar 1 UNL111111111 -0.0136 20 C 1.2361 3.2392 0.2890 C.ar 1 UNL111111111 0.2484 21 O 2.5141 2.7734 0.2533 O.3 1 UNL111111111 -0.3256 22 C 3.5505 3.7051 0.5789 C.3 1 UNL111111111 -0.0328 23 C 4.7945 3.0155 0.1452 C.ar 1 UNL111111111 0.0789 24 N 5.9094 3.6557 -0.2010 N.ar 1 UNL111111111 -0.2430 25 C 5.0027 1.5892 0.0359 C.ar 1 UNL111111111 -0.2733 26 S 6.5890 -1.2558 -0.8729 S.2 1 UNL111111111 0.3551 27 CL 8.5321 -3.4423 -1.5527 Cl 1 UNL111111111 0.0028 28 C -1.0466 2.6791 -0.2714 C.ar 1 UNL111111111 0.2925 29 C -1.4663 3.9167 0.2324 C.ar 1 UNL111111111 -0.3350 30 C -0.5274 4.7955 0.7573 C.ar 1 UNL111111111 -0.0266 31 C 0.8304 4.4765 0.7821 C.ar 1 UNL111111111 -0.3365 32 O -1.8471 1.8118 -0.9308 O.3 1 UNL111111111 -0.3195 33 C -3.2132 1.7040 -0.5145 C.3 1 UNL111111111 -0.0317 34 C -3.3872 0.2548 -0.0616 C.3 1 UNL111111111 -0.3416 35 C -4.8024 -0.0140 0.4342 C.3 1 UNL111111111 -0.0044 36 O -5.4719 -0.6440 -0.6609 O.3 1 UNL111111111 -0.4426 37 C -6.8142 -0.2942 -0.8282 C.3 1 UNL111111111 0.2808 38 C -7.4289 -1.4743 -1.6164 C.3 1 UNL111111111 0.0261 39 O -7.0174 -1.3982 -2.9648 O.3 1 UNL111111111 -0.5581 40 C -8.9589 -1.3440 -1.6666 C.3 1 UNL111111111 0.0678 41 O -9.5319 -2.5717 -2.0696 O.3 1 UNL111111111 -0.5630 42 C -9.5366 -1.1008 -0.2584 C.3 1 UNL111111111 0.0725 43 O -10.8724 -0.6587 -0.3641 O.3 1 UNL111111111 -0.5495 44 C -8.7957 0.0618 0.4320 C.3 1 UNL111111111 0.0494 45 O -7.4069 -0.2272 0.4605 O.3 1 UNL111111111 -0.4797 46 C -9.1776 0.1696 1.9148 C.3 1 UNL111111111 -0.0136 47 O -8.6285 1.3472 2.4630 O.3 1 UNL111111111 -0.5364 48 H 10.1677 -0.9368 -1.4382 H 1 UNL111111111 0.1826 49 H 9.1114 1.3558 -0.8889 H 1 UNL111111111 0.1776 50 H 0.6270 -1.5203 -1.5987 H 1 UNL111111111 0.1574 51 H 2.8238 -2.3898 -0.8361 H 1 UNL111111111 0.1630 52 H 2.9210 -0.6253 -0.9339 H 1 UNL111111111 0.1296 53 H 3.9553 -1.4379 1.1694 H 1 UNL111111111 0.1384 54 H 2.5080 -0.4607 1.5679 H 1 UNL111111111 0.1209 55 H 2.4600 -1.7456 3.7761 H 1 UNL111111111 0.1101 56 H 2.3329 -4.7936 3.2761 H 1 UNL111111111 0.1601 57 H 2.7436 -4.1036 4.8532 H 1 UNL111111111 0.1461 58 H 1.1560 -3.7997 4.1536 H 1 UNL111111111 0.1438 59 H 4.7939 -1.7865 3.0060 H 1 UNL111111111 0.1446 60 H 4.6858 -3.0619 4.2153 H 1 UNL111111111 0.1418 61 H 4.6752 -3.4818 2.4966 H 1 UNL111111111 0.1619 62 H 0.4325 -3.5032 2.2303 H 1 UNL111111111 0.1355 63 H 0.3853 -1.7140 2.2727 H 1 UNL111111111 0.1427 64 H -0.7745 -2.5534 0.2610 H 1 UNL111111111 0.1494 65 H 0.6279 -3.5427 -0.2103 H 1 UNL111111111 0.1464 66 H 1.5161 1.0319 -1.3344 H 1 UNL111111111 0.3196 67 H 3.3983 4.6647 0.0431 H 1 UNL111111111 0.1601 68 H 3.5371 3.8773 1.6758 H 1 UNL111111111 0.1591 69 H 4.2691 0.8434 0.2609 H 1 UNL111111111 0.1963 70 H -2.5138 4.1973 0.1973 H 1 UNL111111111 0.1675 71 H -0.8556 5.7586 1.1519 H 1 UNL111111111 0.1498 72 H 1.5400 5.1834 1.1950 H 1 UNL111111111 0.1674 73 H -3.4763 2.4157 0.2833 H 1 UNL111111111 0.1281 74 H -3.7864 1.9368 -1.4300 H 1 UNL111111111 0.1359 75 H -3.1314 -0.4381 -0.8907 H 1 UNL111111111 0.1738 76 H -2.6423 0.0208 0.7336 H 1 UNL111111111 0.1985 77 H -4.8264 -0.7545 1.2562 H 1 UNL111111111 0.1379 78 H -5.3264 0.8981 0.7614 H 1 UNL111111111 0.1248 79 H -6.8920 0.6897 -1.3330 H 1 UNL111111111 0.1246 80 H -7.1094 -2.4522 -1.1912 H 1 UNL111111111 0.1606 81 H -6.0355 -1.4275 -3.0166 H 1 UNL111111111 0.3382 82 H -9.2782 -0.5587 -2.3900 H 1 UNL111111111 0.1541 83 H -9.1285 -2.8639 -2.9174 H 1 UNL111111111 0.3393 84 H -9.5149 -2.0361 0.3446 H 1 UNL111111111 0.1512 85 H -11.3884 -1.3000 -0.9046 H 1 UNL111111111 0.3385 86 H -8.9707 1.0267 -0.0944 H 1 UNL111111111 0.1522 87 H -10.2716 0.3017 2.0361 H 1 UNL111111111 0.1653 88 H -8.8285 -0.7015 2.4972 H 1 UNL111111111 0.1312 89 H -7.6556 1.3456 2.3377 H 1 UNL111111111 0.3186 @BOND 1 1 26 ar 2 2 1 ar 3 2 3 ar 4 2 48 1 5 3 4 ar 6 3 49 1 7 4 6 1 8 5 24 ar 9 6 25 ar 10 6 5 ar 11 8 7 2 12 9 8 1 13 9 17 1 14 9 50 1 15 10 9 1 16 10 51 1 17 10 52 1 18 11 10 1 19 11 12 1 20 11 53 1 21 11 54 1 22 12 16 1 23 13 12 1 24 13 55 1 25 14 13 1 26 14 56 1 27 14 57 1 28 14 58 1 29 15 13 1 30 15 59 1 31 15 60 1 32 15 61 1 33 16 17 1 34 16 62 1 35 16 63 1 36 17 64 1 37 17 65 1 38 18 8 am 39 18 19 1 40 18 66 1 41 19 20 ar 42 20 31 ar 43 20 21 1 44 21 22 1 45 22 67 1 46 22 68 1 47 23 22 1 48 23 24 ar 49 25 23 ar 50 25 69 1 51 26 4 ar 52 27 1 1 53 28 29 ar 54 28 19 ar 55 29 30 ar 56 29 70 1 57 30 31 ar 58 30 71 1 59 31 72 1 60 32 28 1 61 33 32 1 62 33 73 1 63 33 74 1 64 34 33 1 65 34 75 1 66 34 76 1 67 35 34 1 68 35 77 1 69 35 78 1 70 36 35 1 71 37 45 1 72 37 36 1 73 37 79 1 74 38 37 1 75 38 80 1 76 39 38 1 77 39 81 1 78 40 38 1 79 40 41 1 80 40 82 1 81 41 83 1 82 42 40 1 83 42 44 1 84 42 84 1 85 43 42 1 86 43 85 1 87 44 46 1 88 44 45 1 89 44 86 1 90 46 87 1 91 46 88 1 92 47 46 1 93 47 89 1