DR0723 -OEChem-05042004062D 76 79 0 0 0 0 0 0 0999 V2000 9.7942 -6.7327 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.1884 -4.2052 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 13.8277 -5.5726 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.8210 -3.8444 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.2673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.7673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.7327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.7327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -4.7327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -3.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -3.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -5.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -5.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -6.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -6.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5542 -4.6980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0343 -4.6980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4603 -5.2118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5542 -6.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0343 -6.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4603 -6.2535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1282 -5.2118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1282 -6.2535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3244 -4.7085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 6.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 -2.7076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5947 -2.7076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6728 -0.8403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2742 -0.1501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 -1.6250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 -2.3153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5947 0.2423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 0.2423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5388 -2.3403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1403 -1.6501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3176 -3.1250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7162 -3.8153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -0.1250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -0.8153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4048 -3.8403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0063 -3.1501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 0.6597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 1.3499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5470 -4.0780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0414 -4.0780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 2.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 2.1847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5470 -7.3873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 3.6597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 4.3499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0414 -7.3873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 4.3750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 3.6847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9960 -6.5656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5925 -4.8998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4766 5.1597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0781 5.8499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5925 -6.5656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 5.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 5.1847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 6.7673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 7.3873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 6.7673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 36 1 0 0 0 0 3 36 1 0 0 0 0 4 36 1 0 0 0 0 5 18 1 0 0 0 0 5 26 1 0 0 0 0 6 26 2 0 0 0 0 7 10 1 0 0 0 0 7 11 1 0 0 0 0 7 14 1 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 8 16 1 0 0 0 0 9 17 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 10 12 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 13 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 17 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 18 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 53 1 0 0 0 0 17 54 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 19 21 2 0 0 0 0 19 23 1 0 0 0 0 20 22 1 0 0 0 0 20 24 2 0 0 0 0 21 27 1 0 0 0 0 22 30 2 0 0 0 0 23 25 2 0 0 0 0 23 57 1 0 0 0 0 24 33 1 0 0 0 0 24 58 1 0 0 0 0 25 32 1 0 0 0 0 25 36 1 0 0 0 0 26 28 1 0 0 0 0 27 32 2 0 0 0 0 27 61 1 0 0 0 0 28 29 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 31 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 30 35 1 0 0 0 0 30 64 1 0 0 0 0 31 34 1 0 0 0 0 31 65 1 0 0 0 0 31 66 1 0 0 0 0 32 67 1 0 0 0 0 33 35 2 0 0 0 0 33 68 1 0 0 0 0 34 37 1 0 0 0 0 34 69 1 0 0 0 0 34 70 1 0 0 0 0 35 71 1 0 0 0 0 37 38 1 0 0 0 0 37 72 1 0 0 0 0 37 73 1 0 0 0 0 38 74 1 0 0 0 0 38 75 1 0 0 0 0 38 76 1 0 0 0 0 M END $$$$