@MOLECULE (4-methoxy-5-oxo-5h-furo[3,2-g]chromen-7-yl)methyl beta-l-glucopyranoside 49 52 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 2.0908 -0.5256 -0.3402 O.3 1 UNL1 -0.4611 2 O 2.4987 -1.7629 1.4974 O.3 1 UNL1 -0.3633 3 O 5.5342 1.5356 0.1243 O.3 1 UNL1 -0.5556 4 O 4.0443 1.7203 -2.3346 O.3 1 UNL1 -0.5459 5 O 5.3311 -1.1712 1.2406 O.3 1 UNL1 -0.5292 6 O 0.3574 -0.1603 -2.5205 O.3 1 UNL1 -0.5320 7 O -0.7675 -1.7021 0.2809 O.2 1 UNL1 -0.3045 8 O -5.2217 -1.5662 -1.3090 O.2 1 UNL1 -0.1876 9 O -3.8382 2.0620 1.0268 O.3 1 UNL1 -0.2820 10 O -0.7110 2.1565 1.2140 O.2 1 UNL1 -0.4930 11 C 4.7503 0.4804 -0.3933 C.3 1 UNL1 0.0376 12 C 3.5844 1.1858 -1.1133 C.3 1 UNL1 0.0780 13 C 4.2547 -0.4097 0.7602 C.3 1 UNL1 0.0267 14 C 2.5166 0.1500 -1.5125 C.3 1 UNL1 0.0464 15 C 3.0829 -1.3018 0.2993 C.3 1 UNL1 0.2555 16 C 1.2339 0.8242 -2.0241 C.3 1 UNL1 -0.0149 17 C 1.2023 -2.3055 1.3509 C.3 1 UNL1 -0.0566 18 C 0.1933 -1.2177 1.1287 C.ar 1 UNL1 0.2604 19 C -2.0945 0.3165 0.6557 C.ar 1 UNL1 -0.4427 20 C -1.9361 -0.9976 0.1496 C.ar 1 UNL1 0.3417 21 C 0.1747 0.0329 1.6045 C.ar 1 UNL1 -0.3952 22 C -0.8819 0.9579 1.1781 C.ar 1 UNL1 0.5352 23 C -3.3647 0.9127 0.5399 C.ar 1 UNL1 0.4129 24 C -4.3737 0.2223 -0.1634 C.ar 1 UNL1 -0.2652 25 C -4.1122 -1.0645 -0.6845 C.ar 1 UNL1 0.2721 26 C -2.9007 -1.7262 -0.5360 C.ar 1 UNL1 -0.3778 27 C -5.7486 0.5098 -0.5077 C.ar 1 UNL1 -0.1649 28 C -6.2074 -0.5754 -1.1867 C.ar 1 UNL1 -0.0218 29 C -3.1055 2.8335 1.9730 C.3 1 UNL1 -0.1921 30 H 5.3832 -0.0881 -1.1114 H 1 UNL1 0.1395 31 H 3.1669 2.0073 -0.4878 H 1 UNL1 0.1584 32 H 3.9652 0.1975 1.6549 H 1 UNL1 0.1911 33 H 2.9022 -0.5825 -2.2541 H 1 UNL1 0.1493 34 H 3.3714 -2.1577 -0.3435 H 1 UNL1 0.1155 35 H 1.4482 1.4641 -2.9036 H 1 UNL1 0.1668 36 H 0.7314 1.4150 -1.2353 H 1 UNL1 0.1416 37 H 6.1778 1.1873 0.7813 H 1 UNL1 0.3368 38 H 4.7855 2.3445 -2.1606 H 1 UNL1 0.3374 39 H 5.5739 -1.8958 0.6288 H 1 UNL1 0.3133 40 H 1.0452 -2.8045 2.3336 H 1 UNL1 0.1724 41 H 1.1735 -3.0700 0.5482 H 1 UNL1 0.1544 42 H 0.0510 -0.7332 -1.7834 H 1 UNL1 0.3207 43 H 0.9528 0.4314 2.2504 H 1 UNL1 0.2054 44 H -2.7210 -2.7250 -0.9141 H 1 UNL1 0.2017 45 H -6.2598 1.4176 -0.2574 H 1 UNL1 0.1788 46 H -7.1220 -0.8634 -1.6488 H 1 UNL1 0.1744 47 H -2.3770 3.4623 1.4425 H 1 UNL1 0.1738 48 H -2.6216 2.2139 2.7308 H 1 UNL1 0.1426 49 H -3.9009 3.4467 2.4183 H 1 UNL1 0.1450 @BOND 1 35 16 1 2 6 16 1 3 6 42 1 4 4 38 1 5 4 12 1 6 33 14 1 7 16 14 1 8 16 36 1 9 46 28 1 10 14 12 1 11 14 1 1 12 8 28 ar 13 8 25 ar 14 28 27 ar 15 12 31 1 16 12 11 1 17 30 11 1 18 44 26 1 19 25 26 ar 20 25 24 ar 21 26 20 ar 22 27 45 1 23 27 24 ar 24 11 3 1 25 11 13 1 26 34 15 1 27 1 15 1 28 24 23 ar 29 3 37 1 30 20 7 ar 31 20 19 ar 32 7 18 ar 33 15 13 1 34 15 2 1 35 23 19 ar 36 23 9 1 37 41 17 1 38 39 5 1 39 19 22 ar 40 13 5 1 41 13 32 1 42 9 29 1 43 18 17 1 44 18 21 ar 45 22 10 2 46 22 21 ar 47 17 2 1 48 17 40 1 49 47 29 1 50 21 43 1 51 29 49 1 52 29 48 1