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0 0 0 0 0 0 0 0 0 0 7.7619 6.9282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7619 1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2619 -6.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 -3.4641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7619 -6.9282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6793 2.3860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3695 1.9875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3445 3.6762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6542 4.0747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8445 2.8101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1542 3.2087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1793 3.2520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8695 2.8535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1793 1.5200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8695 1.1215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0719 2.9272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1419 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4519 5.7331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4519 2.9272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3819 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5719 -1.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1419 -1.7320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8819 -2.5981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.9501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.7101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4519 -2.9272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8819 -4.3301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 5.1401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.5201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2988 7.2382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4519 7.4651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2249 6.6182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7619 1.1120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3819 1.7320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7619 2.3521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2619 -6.6822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8819 -6.0622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2619 -5.4422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2988 -3.1541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4519 -2.9272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2249 -3.7741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2249 -7.2382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0719 -7.4651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2988 -6.6182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 29 1 0 0 0 0 2 13 1 0 0 0 0 2 15 1 0 0 0 0 3 14 1 0 0 0 0 3 16 1 0 0 0 0 4 17 1 0 0 0 0 4 42 1 0 0 0 0 5 21 1 0 0 0 0 5 43 1 0 0 0 0 6 37 1 0 0 0 0 6 44 1 0 0 0 0 7 38 1 0 0 0 0 7 45 1 0 0 0 0 8 39 1 0 0 0 0 8 46 1 0 0 0 0 9 25 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 47 1 0 0 0 0 10 48 1 0 0 0 0 11 13 1 0 0 0 0 11 49 1 0 0 0 0 11 50 1 0 0 0 0 12 14 1 0 0 0 0 12 51 1 0 0 0 0 12 52 1 0 0 0 0 13 53 1 0 0 0 0 13 54 1 0 0 0 0 14 55 1 0 0 0 0 14 56 1 0 0 0 0 15 17 2 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 16 21 2 0 0 0 0 17 22 1 0 0 0 0 18 22 2 0 0 0 0 18 24 1 0 0 0 0 18 25 1 0 0 0 0 19 24 2 0 0 0 0 19 57 1 0 0 0 0 20 23 2 0 0 0 0 20 58 1 0 0 0 0 21 26 1 0 0 0 0 22 59 1 0 0 0 0 23 27 1 0 0 0 0 23 28 1 0 0 0 0 24 60 1 0 0 0 0 26 27 2 0 0 0 0 26 61 1 0 0 0 0 27 62 1 0 0 0 0 28 32 2 3 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 29 33 2 0 0 0 0 30 34 2 0 0 0 0 31 32 1 0 0 0 0 31 35 2 0 0 0 0 31 36 1 0 0 0 0 32 64 1 0 0 0 0 33 40 1 0 0 0 0 33 65 1 0 0 0 0 34 41 1 0 0 0 0 34 66 1 0 0 0 0 35 38 1 0 0 0 0 35 67 1 0 0 0 0 36 37 2 0 0 0 0 36 68 1 0 0 0 0 37 39 1 0 0 0 0 38 39 2 0 0 0 0 40 41 2 0 0 0 0 40 69 1 0 0 0 0 41 70 1 0 0 0 0 42 71 1 0 0 0 0 42 72 1 0 0 0 0 42 73 1 0 0 0 0 43 74 1 0 0 0 0 43 75 1 0 0 0 0 43 76 1 0 0 0 0 44 77 1 0 0 0 0 44 78 1 0 0 0 0 44 79 1 0 0 0 0 45 80 1 0 0 0 0 45 81 1 0 0 0 0 45 82 1 0 0 0 0 46 83 1 0 0 0 0 46 84 1 0 0 0 0 46 85 1 0 0 0 0 M END > 68297401 > 1 > 882 > 9 > 0 > 16 > AAADcfB+OABAAAAAAAAAAAAAAAAAAWAAAAAwYMGAAAAAAFgB9AAAHgQAAAAADAyh3gIyx7IIFAikAyRiRACD+KBhKjhImDw27JgNJ6LksZuGOCrlwBXq6Aew8B4OIAABCAAAQQBAAAIQAACCAAAAAAAAAA== > 2-[3-methoxy-4-[5-[2-methoxy-5-[2-(3,4,5-trimethoxyphenyl)vinyl]phenoxy]pentoxy]phenyl]-1,3-benzothiazole > 2-[3-methoxy-4-[5-[2-methoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenoxy]pentoxy]phenyl]-1,3-benzothiazole > 2-[3-methoxy-4-[5-[2-methoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenoxy]pentoxy]phenyl]-1,3-benzothiazole > 2-[3-methoxy-4-[5-[2-methoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenoxy]pentoxy]phenyl]-1,3-benzothiazole > 2-[3-methoxy-4-[5-[2-methoxy-5-[2-(3,4,5-trimethoxyphenyl)ethenyl]phenoxy]pentoxy]phenyl]-1,3-benzothiazole > 2-[3-methoxy-4-[5-[2-methoxy-5-[2-(3,4,5-trimethoxyphenyl)vinyl]phenoxy]pentoxy]phenyl]-1,3-benzothiazole > InChI=1S/C37H39NO7S/c1-39-29-17-15-25(13-14-26-22-33(41-3)36(43-5)34(23-26)42-4)21-32(29)45-20-10-6-9-19-44-30-18-16-27(24-31(30)40-2)37-38-28-11-7-8-12-35(28)46-37/h7-8,11-18,21-24H,6,9-10,19-20H2,1-5H3 > VHCBMZYDLODKMZ-UHFFFAOYSA-N > 8.9 > 641.24472376 > C37H39NO7S > 641.8 > COC1=C(C=C(C=C1)C=CC2=CC(=C(C(=C2)OC)OC)OC)OCCCCCOC3=C(C=C(C=C3)C4=NC5=CC=CC=C5S4)OC > COC1=C(C=C(C=C1)C=CC2=CC(=C(C(=C2)OC)OC)OC)OCCCCCOC3=C(C=C(C=C3)C4=NC5=CC=CC=C5S4)OC > 106 > 641.24472376 > 0 > 46 > 0 > 0 > 0 > 1 > 0 > 1 > -1 > 1 5 255 > 1 25 8 1 29 8 15 17 8 15 19 8 16 20 8 16 21 8 17 22 8 18 22 8 18 24 8 19 24 8 20 23 8 21 26 8 23 27 8 26 27 8 28 32 1 29 30 8 29 33 8 30 34 8 31 35 8 31 36 8 33 40 8 34 41 8 35 38 8 36 37 8 37 39 8 38 39 8 40 41 8 9 25 8 9 30 8 $$$$