Flavonoids TI and TII Spartan HF 3-21G * Mulliken Gross Atomic Populations 12 78 1 1.000000000000000 2 0.6588263025127191 3 1.000000000000000 4 0.4267718919601218 5 0.4650558946153245 6 1.000000000000000 7 0.1755068822426974 8 0.1439301126335526 9 0.1472950339107752 10 1.000000000000000 11 0.1148055728086037 12 0.1352272546301641 13 0.1359400770189017 14 0.8870127704976893 15 1.000000000000000 16 0.1237545577157368 17 0.1734672989342876 18 0.1542010228445453 19 0.2343934043125605 20 0.2337282513795388 21 1.000000000000000 22 0.1236474951670982 23 0.1577406293097562 24 0.1530383474863440 25 0.3151701619640767 26 0.2904142598988805 27 0.5419709804779462 28 1.000000000000000 29 0.1503418320656914 30 0.1442774357379036 31 0.2036344452782078 32 0.4736863815546428 33 0.5577014317581768 34 0.2637324696908444 35 0.3077264017674133 36 1.000000000000000 37 0.1456888645410500 38 0.1425084709169931 39 0.1850244280652024 40 0.5487978900583852 41 0.5973637079892351 42 0.2839921749208294 43 0.3239494100129045 44 0.7115906109131613 45 1.000000000000000 46 0.1402481300460885 47 0.1511288122381553 48 0.1861819557844583 49 0.7161145624503232 50 0.2691248578888651 51 0.2406239823572268 52 0.3026893063170015 53 0.8989085496484902 54 0.6858352723637001 55 1.000000000000000 56 0.1749428179063885 57 0.1535893345415552 58 0.1751984055096659 59 0.8998917880449294 60 0.4981737510697513 61 0.2300760774267132 62 0.2940858686275880 63 0.9813906797910563 64 0.6442269685579523 65 0.5962769285994869 66 1.000000000000000 67 0.1834489508671847 68 0.1347903625537114 69 0.1653635968034163 70 0.3374623585809598 71 0.3594979078308356 72 0.1847743253249553 73 0.1882737003151077 74 0.4149355499350938 75 0.3553492593656177 76 0.3525810596785597 77 0.5573896423284086 78 1.000000000000000 ********> Carbó Index Matrix Triangle_Sum : 44.60897784069041