NCID-ZINC05759728 MOE2007 3D CORINA 3.40 0006 02.08.2006 82 87 0 0 1 0 0 0 0 0999 V2000 0.8910 1.4500 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -0.0840 0.1490 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2970 -0.6960 1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8270 -0.6450 1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 -1.2530 0.0720 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2410 -2.3380 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -0.6390 -1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -0.6940 -1.1530 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8700 -0.0980 -2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -2.1370 -1.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -2.2390 -1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -1.6680 -0.2960 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5200 -1.4840 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -0.2770 0.1460 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3060 0.3970 -0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 0.2320 1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8790 -0.7930 2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -2.1120 2.0660 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7290 -2.6090 0.8620 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8510 -3.7390 1.2850 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1160 -3.9510 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0210 -3.9730 0.4950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -3.9340 2.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 -3.2870 3.1190 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1030 -4.0630 2.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 -2.9310 4.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 -2.9480 5.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2300 -2.6550 6.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1610 -2.3130 7.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 -2.0320 8.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 -2.3300 6.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 -2.6450 5.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 -1.9070 1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8180 -0.9740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6480 -1.8290 0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2960 -2.8110 1.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0760 -1.3730 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0570 -2.2720 1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4980 -1.7970 1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4810 -2.6960 1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9200 -2.2150 1.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9090 -3.1040 2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3770 -2.6860 2.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6090 -1.6660 1.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 1.6840 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 1.9430 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 1.9310 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 -0.1680 2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 -1.7400 1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 0.3880 1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 -1.1730 2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 0.3980 -1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 -1.1480 -2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -2.5020 -2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -2.8060 -0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 -1.6760 -2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -3.2790 -1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 1.1270 1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7100 0.5650 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -0.9940 2.9860 H 0 0 0 0 0 0 0 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-4.1360 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1850 -3.4320 2.8500 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 45 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 48 1 0 0 0 0 3 49 1 0 0 0 0 4 5 1 0 0 0 0 4 50 1 0 0 0 0 4 51 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 34 1 0 0 0 0 7 8 1 0 0 0 0 7 52 1 0 0 0 0 7 53 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 54 1 0 0 0 0 10 55 1 0 0 0 0 11 12 1 0 0 0 0 11 56 1 0 0 0 0 11 57 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 58 1 0 0 0 0 16 59 1 0 0 0 0 17 18 1 0 0 0 0 17 60 1 0 0 0 0 17 61 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 62 1 0 0 0 0 23 63 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 32 2 0 0 0 0 27 28 2 0 0 0 0 27 64 1 0 0 0 0 28 29 1 0 0 0 0 28 65 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 32 66 1 0 0 0 0 33 67 1 0 0 0 0 33 68 1 0 0 0 0 33 69 1 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 38 1 0 0 0 0 37 70 1 0 0 0 0 37 71 1 0 0 0 0 38 39 1 0 0 0 0 38 72 1 0 0 0 0 38 73 1 0 0 0 0 39 40 1 0 0 0 0 39 74 1 0 0 0 0 39 75 1 0 0 0 0 40 41 1 0 0 0 0 40 76 1 0 0 0 0 40 77 1 0 0 0 0 41 42 1 0 0 0 0 41 78 1 0 0 0 0 41 79 1 0 0 0 0 42 43 1 0 0 0 0 42 80 1 0 0 0 0 42 81 1 0 0 0 0 43 44 2 0 0 0 0 43 82 1 0 0 0 0 M CHG 1 82 -1 M END