NCID-ZINC05049590 MOE2007 3D CORINA 3.40 0006 02.08.2006 80 82 0 0 1 0 0 0 0 0999 V2000 0.6990 -1.7060 0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -1.8530 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2130 -0.3990 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 0.0550 -2.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 -0.3040 1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 1.1930 1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0830 1.4310 2.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 2.9280 3.2350 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3070 3.4180 3.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8550 3.1000 4.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 3.4970 2.2730 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3090 4.8270 1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 5.8310 2.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 7.1320 1.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 6.5150 0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3040 5.1690 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1310 4.2160 0.4500 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0720 4.6260 -0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2030 5.9470 -0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3530 6.8810 -0.3180 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2230 6.4360 -1.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9530 7.5530 -2.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8950 8.0430 -3.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1310 7.3890 -3.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4480 6.2970 -2.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4890 5.8300 -1.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7000 5.7610 -2.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.0820 4.7070 -2.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0820 7.8750 -4.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.9350 7.2490 -5.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7030 9.1240 -4.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5180 9.8880 -4.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 8.1090 2.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7990 9.4390 2.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5440 10.0320 1.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 10.0440 2.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 11.4570 2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 11.9700 3.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -2.6480 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 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0 0 0 0 0 0 0 -6.9790 8.0290 -2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7290 4.9950 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0640 5.0330 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1130 4.4310 -2.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4570 3.8220 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9610 7.4760 -6.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0780 6.1650 -5.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7100 7.6500 -6.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6290 9.3040 -4.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5620 10.7450 -4.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4540 10.2770 -3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 7.8420 3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 11.6520 1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6140 11.9540 2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 11.7620 4.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 11.4650 3.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 13.0480 3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -0.5310 0.0840 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6410 0.2200 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5980 7.4600 1.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 42 1 0 0 0 0 2 43 1 0 0 0 0 2 78 1 0 0 0 0 3 4 1 0 0 0 0 3 44 1 0 0 0 0 3 45 1 0 0 0 0 3 78 1 0 0 0 0 4 46 1 0 0 0 0 4 47 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 49 1 0 0 0 0 5 50 1 0 0 0 0 5 78 1 0 0 0 0 6 7 1 0 0 0 0 6 51 1 0 0 0 0 6 52 1 0 0 0 0 7 8 1 0 0 0 0 7 53 1 0 0 0 0 7 54 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 55 1 0 0 0 0 10 56 1 0 0 0 0 10 57 1 0 0 0 0 11 12 1 0 0 0 0 11 58 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 59 1 0 0 0 0 14 33 1 0 0 0 0 14 80 2 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 15 80 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 60 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 61 1 0 0 0 0 23 24 1 0 0 0 0 23 31 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 62 1 0 0 0 0 27 28 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 29 30 1 0 0 0 0 30 66 1 0 0 0 0 30 67 1 0 0 0 0 30 68 1 0 0 0 0 31 32 1 0 0 0 0 32 69 1 0 0 0 0 32 70 1 0 0 0 0 32 71 1 0 0 0 0 33 34 1 0 0 0 0 33 72 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 37 73 1 0 0 0 0 37 74 1 0 0 0 0 38 75 1 0 0 0 0 38 76 1 0 0 0 0 38 77 1 0 0 0 0 78 79 1 0 0 0 0 M CHG 1 78 1 M END