@MOLECULE 1-hydroxy-10-methoxy-8-methyl-6-oxo-6h-dibenzo[c,h]chromen-12-yl 6-deoxy-alpha-l-mannopyranoside 58 62 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C 2.3470 0.9255 1.0955 C.3 1 UNL1 0.3017 2 C 3.8632 0.8153 1.4059 C.3 1 UNL1 0.0181 3 C 4.6734 0.5361 0.1273 C.3 1 UNL1 0.0704 4 C 2.7042 1.3195 -1.2358 C.3 1 UNL1 0.1274 5 C 4.2235 1.4713 -1.0126 C.3 1 UNL1 0.0463 6 C -0.3277 0.1268 0.5292 C.ar 1 UNL1 -0.2504 7 C -1.0036 -3.9728 -0.3390 C.ar 1 UNL1 -0.2040 8 C -5.2292 0.7485 -0.0394 C.ar 1 UNL1 -0.1882 9 C -3.9006 2.7559 0.1048 C.ar 1 UNL1 -0.2995 10 C 1.3583 -4.4462 -0.1646 C.ar 1 UNL1 -0.2727 11 C 0.0404 -4.8711 -0.3932 C.ar 1 UNL1 -0.0711 12 C 2.1656 2.3153 -2.2478 C.3 1 UNL1 -0.4614 13 C -6.3918 2.9626 0.0360 C.3 1 UNL1 -0.4577 14 C -1.3389 3.9033 0.0650 C.3 1 UNL1 -0.2089 15 H 3.0141 -1.8414 0.5291 H 1 UNL1 0.3439 16 H 4.1474 2.1975 2.8049 H 1 UNL1 0.3260 17 H 6.2035 1.5715 0.8243 H 1 UNL1 0.3345 18 H 5.7700 0.8612 -2.0745 H 1 UNL1 0.3349 19 C 0.7070 -0.7687 0.5487 C.ar 1 UNL1 0.2660 20 C -2.7440 1.9834 0.1328 C.ar 1 UNL1 0.2411 21 C 1.5987 -3.1142 0.1299 C.ar 1 UNL1 0.3163 22 C -5.1530 2.1360 0.0317 C.ar 1 UNL1 0.0955 23 O -5.2131 -2.1055 -0.2086 O.2 1 UNL1 -0.4196 24 O 2.9033 -2.8020 0.3073 O.3 1 UNL1 -0.4705 25 O 4.2881 2.0911 1.8416 O.3 1 UNL1 -0.5412 26 O 6.0470 0.7175 0.3573 O.3 1 UNL1 -0.5394 27 O 4.8179 1.0618 -2.2246 O.3 1 UNL1 -0.5477 28 O 1.9754 -0.4417 0.9363 O.3 1 UNL1 -0.4887 29 O -1.4895 2.4937 0.1620 O.3 1 UNL1 -0.2962 30 C -4.1958 -1.4697 -0.1365 C.ar 1 UNL1 0.5821 31 C -1.6408 -0.3082 0.2036 C.ar 1 UNL1 -0.0509 32 C -1.8272 -1.6591 -0.0150 C.ar 1 UNL1 0.1619 33 C -2.7928 0.5670 0.1191 C.ar 1 UNL1 -0.0465 34 C -4.0598 -0.0145 -0.0058 C.ar 1 UNL1 -0.1102 35 O -3.0445 -2.2312 -0.2245 O.2 1 UNL1 -0.3308 36 O 2.0441 1.6769 -0.0182 O.3 1 UNL1 -0.4135 37 C -0.7590 -2.6135 -0.0449 C.ar 1 UNL1 0.0384 38 C 0.5524 -2.1551 0.2179 C.ar 1 UNL1 -0.1718 39 H 1.7503 1.3953 1.9071 H 1 UNL1 0.1510 40 H -0.1552 1.1746 0.7729 H 1 UNL1 0.1988 41 H 4.0664 0.0516 2.1875 H 1 UNL1 0.1518 42 H -2.0286 -4.2986 -0.5243 H 1 UNL1 0.1811 43 H -6.1960 0.2473 -0.1226 H 1 UNL1 0.1827 44 H 4.6085 -0.5369 -0.1764 H 1 UNL1 0.1677 45 H 2.4356 0.2722 -1.4995 H 1 UNL1 0.1483 46 H 4.5123 2.5255 -0.8136 H 1 UNL1 0.1465 47 H -3.8474 3.8398 0.1398 H 1 UNL1 0.1661 48 H 2.1876 -5.1473 -0.2184 H 1 UNL1 0.1765 49 H -0.1463 -5.9214 -0.6197 H 1 UNL1 0.1539 50 H 2.2793 3.3496 -1.9015 H 1 UNL1 0.1546 51 H 2.7061 2.2174 -3.2012 H 1 UNL1 0.1743 52 H 1.0973 2.1487 -2.4396 H 1 UNL1 0.1628 53 H -6.6615 3.2557 1.0634 H 1 UNL1 0.1660 54 H -6.2779 3.8882 -0.5450 H 1 UNL1 0.1577 55 H -7.2576 2.4282 -0.3816 H 1 UNL1 0.1644 56 H -1.7672 4.2835 -0.8672 H 1 UNL1 0.1363 57 H -1.7629 4.4037 0.9397 H 1 UNL1 0.1329 58 H -0.2429 4.0080 0.0520 H 1 UNL1 0.1631 @BOND 1 51 12 1 2 52 12 1 3 12 50 1 4 12 4 1 5 27 18 1 6 27 5 1 7 45 4 1 8 4 5 1 9 4 36 1 10 5 46 1 11 5 3 1 12 56 14 1 13 49 11 1 14 54 13 1 15 42 7 1 16 11 7 ar 17 11 10 ar 18 55 13 1 19 7 37 ar 20 35 30 ar 21 35 32 ar 22 48 10 1 23 23 30 2 24 44 3 1 25 10 21 ar 26 30 34 ar 27 43 8 1 28 37 32 ar 29 37 38 ar 30 8 34 ar 31 8 22 ar 32 36 1 1 33 32 31 ar 34 34 33 ar 35 22 13 1 36 22 9 ar 37 13 53 1 38 58 14 1 39 14 29 1 40 14 57 1 41 9 20 ar 42 9 47 1 43 33 20 ar 44 33 31 ar 45 3 26 1 46 3 2 1 47 21 38 ar 48 21 24 1 49 20 29 1 50 31 6 ar 51 38 19 ar 52 24 15 1 53 26 17 1 54 6 19 ar 55 6 40 1 56 19 28 1 57 28 1 1 58 1 2 1 59 1 39 1 60 2 25 1 61 2 41 1 62 25 16 1