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0 0 0 0 0 0 0 0 0 0 0 13.4005 -1.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1325 -2.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4944 -0.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6246 -1.0302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4005 -1.0508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0265 -0.4753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5066 -2.5446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6005 -2.0307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6400 0.9697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5066 -0.4753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 0.4764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0265 -2.5446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6005 -0.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6005 -2.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9326 -0.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4005 -2.0924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9326 -2.0307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8684 -2.0374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1326 -1.0441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4944 -2.6062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 2.0111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 0.9902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8646 -1.0374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0044 -2.5407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9966 -0.5408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1364 -2.0441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 2.0319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 2.5457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8751 1.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8635 2.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7469 0.5447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6070 1.0547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7237 2.5446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5955 2.0546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5137 -3.1645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0647 -0.6770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4683 -2.3428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4873 -3.2262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3284 0.6782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9943 0.0792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6007 -2.3562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 3.1657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9848 0.8409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5482 -3.8607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7131 -3.1747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3348 -0.7937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3231 2.3384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7540 -0.0752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -3.2157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5516 3.1142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 0.0859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4725 -3.8528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1288 2.3708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0024 3.1552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0121 0.8809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2455 3.8607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 21 1 0 0 0 0 2 20 1 0 0 0 0 2 22 1 0 0 0 0 3 23 1 0 0 0 0 3 29 1 0 0 0 0 4 24 1 0 0 0 0 4 31 1 0 0 0 0 5 25 1 0 0 0 0 5 39 1 0 0 0 0 6 28 1 0 0 0 0 6 38 1 0 0 0 0 7 26 1 0 0 0 0 7 49 1 0 0 0 0 8 30 1 0 0 0 0 8 63 1 0 0 0 0 9 32 1 0 0 0 0 9 64 1 0 0 0 0 10 34 1 0 0 0 0 10 65 1 0 0 0 0 11 35 1 0 0 0 0 11 66 1 0 0 0 0 12 36 1 0 0 0 0 12 69 1 0 0 0 0 13 41 1 0 0 0 0 13 70 1 0 0 0 0 14 43 1 0 0 0 0 14 71 1 0 0 0 0 15 44 1 0 0 0 0 15 72 1 0 0 0 0 16 47 1 0 0 0 0 16 74 1 0 0 0 0 17 52 1 0 0 0 0 17 75 1 0 0 0 0 18 53 1 0 0 0 0 18 76 1 0 0 0 0 19 22 2 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 27 2 0 0 0 0 21 30 2 0 0 0 0 22 32 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 24 34 1 0 0 0 0 25 36 2 0 0 0 0 26 35 2 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 33 2 0 0 0 0 29 31 1 0 0 0 0 29 41 2 0 0 0 0 30 33 1 0 0 0 0 31 42 2 0 0 0 0 32 37 2 0 0 0 0 33 56 1 0 0 0 0 34 40 2 0 0 0 0 35 37 1 0 0 0 0 36 40 1 0 0 0 0 37 57 1 0 0 0 0 38 43 2 0 0 0 0 38 44 1 0 0 0 0 39 45 2 0 0 0 0 39 46 1 0 0 0 0 40 58 1 0 0 0 0 41 48 1 0 0 0 0 42 47 1 0 0 0 0 42 59 1 0 0 0 0 43 45 1 0 0 0 0 44 46 2 0 0 0 0 45 60 1 0 0 0 0 46 61 1 0 0 0 0 47 48 2 0 0 0 0 48 62 1 0 0 0 0 49 50 2 0 0 0 0 49 51 1 0 0 0 0 50 53 1 0 0 0 0 50 67 1 0 0 0 0 51 52 2 0 0 0 0 51 68 1 0 0 0 0 52 54 1 0 0 0 0 53 54 2 0 0 0 0 54 73 1 0 0 0 0 M END > 3008868 > 1 > 1240 > 18 > 11 > 6 > AAADceB8PgAAAAAAAAAAAAAAAAAAAAAAAAA0aMGDAAAAAACRVAAAGgAACAAACASAkAAwBoAABgCAACBCAAACCAAgIAAAiAAGiIgNJyKGMRqCeCOlwBULuAfAYAwAAQAACAAAQAACAAAQAACAAAAAAAAAAA== > 4-[4-[6-(3,5-dihydroxyphenoxy)-4,7,9-trihydroxy-dibenzo-p-dioxin-2-yl]oxy-3,5-dihydroxy-phenoxy]dibenzo-p-dioxin-1,3,6,8-tetrol > 4-[4-[[6-(3,5-dihydroxyphenoxy)-4,7,9-trihydroxy-2-dibenzo-p-dioxinyl]oxy]-3,5-dihydroxyphenoxy]dibenzo-p-dioxin-1,3,6,8-tetrol > 4-[4-[6-(3,5-dihydroxyphenoxy)-4,7,9-trihydroxydibenzo-p-dioxin-2-yl]oxy-3,5-dihydroxyphenoxy]dibenzo-p-dioxin-1,3,6,8-tetrol > 4-[4-[6-(3,5-dihydroxyphenoxy)-4,7,9-trihydroxydibenzo-p-dioxin-2-yl]oxy-3,5-dihydroxyphenoxy]dibenzo-p-dioxin-1,3,6,8-tetrol > 4-[4-[6-[3,5-bis(oxidanyl)phenoxy]-4,7,9-tris(oxidanyl)dibenzo-p-dioxin-2-yl]oxy-3,5-bis(oxidanyl)phenoxy]dibenzo-p-dioxin-1,3,6,8-tetrol > 4-[4-[6-(3,5-dihydroxyphenoxy)-4,7,9-trihydroxy-dibenzo-p-dioxin-2-yl]oxy-3,5-dihydroxy-phenoxy]dibenzo-p-dioxin-1,3,6,8-tetrol > InChI=1S/C36H22O18/c37-12-1-13(38)3-15(2-12)49-31-22(44)10-25(47)34-35(31)54-30-21(43)8-17(9-27(30)52-34)48-28-19(41)6-16(7-20(28)42)50-32-23(45)11-24(46)33-36(32)53-29-18(40)4-14(39)5-26(29)51-33/h1-11,37-47H > DRZQFGYIIYNNEC-UHFFFAOYSA-N > 4.9 > 742.08061385 > C36H22O18 > 742.5 > C1=C(C=C(C=C1O)OC2=C(C=C(C3=C2OC4=C(C=C(C=C4O3)OC5=C(C=C(C=C5O)OC6=C(C=C(C7=C6OC8=C(C=C(C=C8O7)O)O)O)O)O)O)O)O)O > C1=C(C=C(C=C1O)OC2=C(C=C(C3=C2OC4=C(C=C(C=C4O3)OC5=C(C=C(C=C5O)OC6=C(C=C(C7=C6OC8=C(C=C(C=C8O7)O)O)O)O)O)O)O)O)O > 287 > 742.08061385 > 0 > 54 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 19 22 8 19 26 8 20 21 8 20 27 8 21 30 8 22 32 8 23 24 8 23 25 8 24 34 8 25 36 8 26 35 8 27 28 8 28 33 8 29 31 8 29 41 8 30 33 8 31 42 8 32 37 8 34 40 8 35 37 8 36 40 8 38 43 8 38 44 8 39 45 8 39 46 8 41 48 8 42 47 8 43 45 8 44 46 8 47 48 8 49 50 8 49 51 8 50 53 8 51 52 8 52 54 8 53 54 8 $$$$