@MOLECULE (2r,4s)-5-(beta-d-threo-hexopyranosyloxy)-4-hydroxy-2-(4-methoxyphenyl)-6,8-dimethyl-3,4-dihydro-2h-chromen-7-yl beta-d-threo-hexopyranoside 85 89 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -3.1873 -2.8249 1.0144 O.3 1 UNL1 -0.4088 2 C -2.5166 -1.6950 0.4766 C.3 1 UNL1 0.2891 3 C -2.2288 -1.9097 -1.0250 C.3 1 UNL1 0.0467 4 C -3.5030 -2.3285 -1.7822 C.3 1 UNL1 0.0447 5 C -4.3003 -3.4093 -1.0312 C.3 1 UNL1 0.0345 6 C -4.4721 -3.0253 0.4482 C.3 1 UNL1 0.0064 7 O -1.3152 -1.7241 1.2532 O.3 1 UNL1 -0.3850 8 C -0.4065 -0.7460 0.9022 C.ar 1 UNL1 0.2415 9 C -0.6179 0.5749 1.3072 C.ar 1 UNL1 -0.2649 10 C -1.8182 0.9899 2.1061 C.3 1 UNL1 0.2043 11 C -1.5311 2.3184 2.8237 C.3 1 UNL1 -0.3541 12 C -0.9845 3.3070 1.7950 C.3 1 UNL1 0.1212 13 O 0.2597 2.8409 1.2683 O.3 1 UNL1 -0.3275 14 C 0.3558 1.5177 0.9730 C.ar 1 UNL1 0.2454 15 C 1.5432 1.1685 0.3023 C.ar 1 UNL1 -0.1260 16 C 1.7323 -0.1787 0.0055 C.ar 1 UNL1 0.1986 17 C 0.7711 -1.1640 0.2828 C.ar 1 UNL1 -0.0990 18 O -1.8545 -0.6275 -1.4793 O.3 1 UNL1 -0.5440 19 O -3.0218 -2.8583 -3.0015 O.3 1 UNL1 -0.5592 20 O -5.5473 -3.5870 -1.6545 O.3 1 UNL1 -0.5423 21 C -5.0417 -4.1859 1.2787 C.3 1 UNL1 -0.0136 22 O -5.5882 -3.6841 2.4756 O.3 1 UNL1 -0.5368 23 O -2.1256 0.0668 3.1318 O.3 1 UNL1 -0.5795 24 C -1.9764 3.5669 0.6933 C.ar 1 UNL1 -0.1403 25 C -3.1789 4.2093 1.0137 C.ar 1 UNL1 -0.0936 26 C -4.1475 4.4131 0.0438 C.ar 1 UNL1 -0.2531 27 C -3.8974 3.9676 -1.2650 C.ar 1 UNL1 0.2483 28 C -2.6945 3.3555 -1.6097 C.ar 1 UNL1 -0.2936 29 C -1.7338 3.1648 -0.6173 C.ar 1 UNL1 -0.0577 30 C 2.5291 2.2160 -0.0585 C.3 1 UNL1 -0.4105 31 O 2.8394 -0.6182 -0.6907 O.3 1 UNL1 -0.3373 32 C 4.0347 -0.6457 0.0662 C.3 1 UNL1 0.2944 33 O 4.6936 0.5507 -0.3288 O.3 1 UNL1 -0.4497 34 C 6.0568 0.6426 0.0284 C.3 1 UNL1 0.0122 35 C 6.8263 -0.4449 -0.7392 C.3 1 UNL1 0.0379 36 C 6.3009 -1.8213 -0.3066 C.3 1 UNL1 0.0377 37 C 4.7695 -1.9146 -0.4305 C.3 1 UNL1 0.0579 38 C 1.0303 -2.5847 -0.0561 C.3 1 UNL1 -0.4240 39 O -4.9382 4.2027 -2.1083 O.3 1 UNL1 -0.3235 40 C -4.7765 3.8063 -3.4629 C.3 1 UNL1 -0.2023 41 C 6.4599 2.0535 -0.4286 C.3 1 UNL1 -0.0131 42 O 6.0039 3.0010 0.5086 O.3 1 UNL1 -0.5402 43 O 8.2088 -0.3658 -0.5071 O.3 1 UNL1 -0.5399 44 O 6.7824 -2.8289 -1.1739 O.3 1 UNL1 -0.5589 45 O 4.3214 -2.9182 0.4601 O.3 1 UNL1 -0.5534 46 H -3.0808 -0.7632 0.6908 H 1 UNL1 0.1407 47 H -1.4017 -2.6361 -1.1892 H 1 UNL1 0.1672 48 H -4.1338 -1.4414 -2.0205 H 1 UNL1 0.1436 49 H -3.8207 -4.4109 -1.1491 H 1 UNL1 0.1751 50 H -5.0925 -2.1097 0.5742 H 1 UNL1 0.1458 51 H -2.7294 1.0727 1.4628 H 1 UNL1 0.1321 52 H -0.7997 2.1485 3.6397 H 1 UNL1 0.1764 53 H -2.4444 2.6960 3.3150 H 1 UNL1 0.1656 54 H -0.6461 4.2631 2.2673 H 1 UNL1 0.1542 55 H -1.4663 -0.6900 -2.3810 H 1 UNL1 0.3376 56 H -3.7519 -3.3019 -3.4866 H 1 UNL1 0.3341 57 H -6.1412 -2.8206 -1.5102 H 1 UNL1 0.3193 58 H -4.2672 -4.9411 1.5114 H 1 UNL1 0.1400 59 H -5.9009 -4.6675 0.7725 H 1 UNL1 0.1590 60 H -4.8948 -3.2053 2.9828 H 1 UNL1 0.3270 61 H -1.9253 -0.8488 2.8444 H 1 UNL1 0.3446 62 H -3.3608 4.5477 2.0341 H 1 UNL1 0.1525 63 H -5.0883 4.9054 0.2745 H 1 UNL1 0.1700 64 H -2.4937 3.0232 -2.6218 H 1 UNL1 0.1639 65 H -0.7875 2.6873 -0.8846 H 1 UNL1 0.1700 66 H 2.0539 3.1964 -0.2189 H 1 UNL1 0.1618 67 H 3.0696 1.9627 -0.9875 H 1 UNL1 0.1736 68 H 3.2758 2.3433 0.7414 H 1 UNL1 0.1490 69 H 3.8596 -0.6321 1.1611 H 1 UNL1 0.1461 70 H 6.1654 0.5389 1.1307 H 1 UNL1 0.1414 71 H 6.7546 -0.3085 -1.8446 H 1 UNL1 0.1767 72 H 6.6345 -2.0858 0.7241 H 1 UNL1 0.1431 73 H 4.4641 -2.1777 -1.4703 H 1 UNL1 0.1678 74 H 0.2722 -3.2642 0.3599 H 1 UNL1 0.1634 75 H 2.0081 -2.9139 0.3428 H 1 UNL1 0.1803 76 H 1.0718 -2.7393 -1.1442 H 1 UNL1 0.1560 77 H -5.7411 4.0901 -3.9053 H 1 UNL1 0.1525 78 H -4.6231 2.7253 -3.5385 H 1 UNL1 0.1343 79 H -3.9607 4.3619 -3.9360 H 1 UNL1 0.1361 80 H 6.0508 2.2911 -1.4275 H 1 UNL1 0.1366 81 H 7.5592 2.1848 -0.4277 H 1 UNL1 0.1582 82 H 5.0217 2.9543 0.5781 H 1 UNL1 0.3230 83 H 8.4210 -0.3712 0.4498 H 1 UNL1 0.3187 84 H 7.7315 -2.6734 -1.3779 H 1 UNL1 0.3370 85 H 4.7089 -3.7855 0.2062 H 1 UNL1 0.3364 @BOND 1 79 40 1 2 77 40 1 3 78 40 1 4 56 19 1 5 40 39 1 6 19 4 1 7 64 28 1 8 55 18 1 9 39 27 1 10 48 4 1 11 71 35 1 12 4 5 1 13 4 3 1 14 20 57 1 15 20 5 1 16 28 27 ar 17 28 29 ar 18 18 3 1 19 73 37 1 20 80 41 1 21 84 44 1 22 27 26 ar 23 47 3 1 24 44 36 1 25 49 5 1 26 76 38 1 27 5 6 1 28 3 2 1 29 67 30 1 30 65 29 1 31 35 43 1 32 35 36 1 33 35 34 1 34 31 16 1 35 31 32 1 36 29 24 ar 37 43 83 1 38 37 36 1 39 37 32 1 40 37 45 1 41 41 81 1 42 41 34 1 43 41 42 1 44 33 34 1 45 33 32 1 46 36 72 1 47 66 30 1 48 30 15 1 49 30 68 1 50 38 17 1 51 38 75 1 52 38 74 1 53 16 17 ar 54 16 15 ar 55 34 70 1 56 26 63 1 57 26 25 ar 58 32 69 1 59 85 45 1 60 17 8 ar 61 15 14 ar 62 6 50 1 63 6 1 1 64 6 21 1 65 2 46 1 66 2 1 1 67 2 7 1 68 42 82 1 69 24 25 ar 70 24 12 1 71 59 21 1 72 8 7 1 73 8 9 ar 74 14 13 1 75 14 9 ar 76 25 62 1 77 13 12 1 78 21 58 1 79 21 22 1 80 9 10 1 81 51 10 1 82 12 54 1 83 12 11 1 84 10 11 1 85 10 23 1 86 22 60 1 87 11 53 1 88 11 52 1 89 61 23 1