@MOLECULE 5,7-dihydroxy-2-(4-hydroxyphenoxy)-4h-chromen-4-one 31 33 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -0.0937 0.1956 0.0076 O.2 1 UNL1 -0.3132 2 O -1.4311 2.0149 0.0129 O.3 1 UNL1 -0.2728 3 O 4.6590 0.4285 -0.0102 O.3 1 UNL1 -0.3785 4 O 2.3171 -3.7538 -0.0106 O.3 1 UNL1 -0.4508 5 O 3.2276 2.5858 0.0074 O.2 1 UNL1 -0.4382 6 O -5.5623 -1.5620 0.0667 O.3 1 UNL1 -0.4645 7 C 2.3253 0.3976 0.0006 C.ar 1 UNL1 -0.4170 8 C 1.1541 -0.3688 0.0030 C.ar 1 UNL1 0.3796 9 C 3.5417 -0.3123 -0.0071 C.ar 1 UNL1 0.4416 10 C 2.2554 1.8695 0.0062 C.ar 1 UNL1 0.5393 11 C 1.1319 -1.7603 0.0004 C.ar 1 UNL1 -0.4157 12 C -0.1580 1.5664 0.0101 C.ar 1 UNL1 0.4598 13 C 0.8918 2.4023 0.0100 C.ar 1 UNL1 -0.4984 14 C 2.3724 -2.4060 -0.0073 C.ar 1 UNL1 0.4317 15 C 3.5869 -1.7123 -0.0117 C.ar 1 UNL1 -0.5379 16 C -2.4201 1.0294 0.0020 C.ar 1 UNL1 0.1023 17 C -2.9075 0.5713 1.2268 C.ar 1 UNL1 -0.1134 18 C -2.9437 0.6423 -1.2271 C.ar 1 UNL1 -0.1047 19 C -3.9802 -0.3084 1.2210 C.ar 1 UNL1 -0.2226 20 C -4.0196 -0.2416 -1.2371 C.ar 1 UNL1 -0.2884 21 C -4.5179 -0.6998 -0.0142 C.ar 1 UNL1 0.2860 22 H 0.2026 -2.3215 0.0041 H 1 UNL1 0.2054 23 H 0.7855 3.4836 0.0126 H 1 UNL1 0.2137 24 H 4.5299 -2.2385 -0.0180 H 1 UNL1 0.1761 25 H -2.4508 0.9022 2.1595 H 1 UNL1 0.1759 26 H -2.5195 1.0247 -2.1551 H 1 UNL1 0.1739 27 H -4.4059 -0.6988 2.1435 H 1 UNL1 0.1829 28 H -4.4557 -0.5670 -2.1760 H 1 UNL1 0.1671 29 H 5.4839 -0.1279 -0.0150 H 1 UNL1 0.3183 30 H 3.2148 -4.1735 -0.0147 H 1 UNL1 0.3333 31 H -5.9128 -1.8138 -0.8227 H 1 UNL1 0.3295 @BOND 1 28 20 1 2 26 18 1 3 20 18 ar 4 20 21 ar 5 18 16 ar 6 31 6 1 7 24 15 1 8 29 3 1 9 30 4 1 10 21 6 1 11 21 19 ar 12 15 14 ar 13 15 9 ar 14 4 14 1 15 3 9 1 16 14 11 ar 17 9 7 ar 18 11 8 ar 19 11 22 1 20 7 8 ar 21 7 10 ar 22 16 2 1 23 16 17 ar 24 8 1 ar 25 10 5 2 26 10 13 ar 27 1 12 ar 28 13 12 ar 29 13 23 1 30 12 2 1 31 19 17 ar 32 19 27 1 33 17 25 1