PUBCHEM-ZINC05221944 MOE2007 3D CORINA 3.40 0006 02.08.2006 102106 0 0 1 0 0 0 0 0999 V2000 1.6060 -0.4650 0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 0.5450 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 1.4450 -1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 0.3970 -1.2430 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3390 -0.6770 -1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 1.0950 -2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1850 1.0160 -2.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6760 0.5060 -1.2400 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4620 0.7570 -0.2830 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4800 0.0260 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 2.2010 0.3280 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0990 2.8530 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 2.3830 1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 1.6570 2.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 2.1530 3.3760 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7780 3.1930 3.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 1.3890 4.7730 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9650 1.1250 5.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 -0.2030 5.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 -1.3610 5.5910 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5860 -1.2870 6.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -1.3450 4.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 0.0780 4.6680 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6820 0.0430 5.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2900 0.2240 3.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 0.8450 2.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 2.2340 2.3530 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7750 2.7810 0.8640 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8370 2.5980 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9850 1.2070 -0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5800 4.3440 0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3180 3.2290 2.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0780 -1.8610 3.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 -2.4080 5.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -2.5990 5.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -3.1060 6.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -2.5870 7.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -4.4000 6.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -5.1250 7.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -6.4560 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-8.3670 -5.3280 -3.4410 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 51 1 0 0 0 0 1 52 1 0 0 0 0 1 53 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 3 54 1 0 0 0 0 3 55 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 1 0 0 0 0 6 56 1 0 0 0 0 6 57 1 0 0 0 0 7 8 1 0 0 0 0 7 58 1 0 0 0 0 7 59 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 28 1 0 0 0 0 13 14 1 0 0 0 0 13 60 1 0 0 0 0 13 61 1 0 0 0 0 14 15 1 0 0 0 0 14 62 1 0 0 0 0 14 63 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 27 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 64 1 0 0 0 0 18 65 1 0 0 0 0 19 20 1 0 0 0 0 19 66 1 0 0 0 0 19 67 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 35 1 0 0 0 0 22 23 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 68 1 0 0 0 0 25 69 1 0 0 0 0 26 27 1 0 0 0 0 26 70 1 0 0 0 0 26 71 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 72 1 0 0 0 0 29 73 1 0 0 0 0 30 74 1 0 0 0 0 30 75 1 0 0 0 0 31 76 1 0 0 0 0 31 77 1 0 0 0 0 31 78 1 0 0 0 0 32 79 1 0 0 0 0 32 80 1 0 0 0 0 32 81 1 0 0 0 0 33 82 1 0 0 0 0 33 83 1 0 0 0 0 33 84 1 0 0 0 0 34 85 1 0 0 0 0 34 86 1 0 0 0 0 34 87 1 0 0 0 0 35 36 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 38 39 1 0 0 0 0 38 88 1 0 0 0 0 38 89 1 0 0 0 0 39 40 1 0 0 0 0 39 90 1 0 0 0 0 39 91 1 0 0 0 0 40 41 2 0 0 0 0 40101 1 0 0 0 0 42 92 1 0 0 0 0 42 93 1 0 0 0 0 42 94 1 0 0 0 0 43 44 1 0 0 0 0 43 95 1 0 0 0 0 43 96 1 0 0 0 0 44 45 1 0 0 0 0 45 46 2 0 0 0 0 45 47 1 0 0 0 0 47 48 1 0 0 0 0 47 97 1 0 0 0 0 47 98 1 0 0 0 0 48 49 1 0 0 0 0 48 99 1 0 0 0 0 48100 1 0 0 0 0 49 50 2 0 0 0 0 49102 1 0 0 0 0 M CHG 1 101 -1 M CHG 1 102 -1 M END