ANALYTICONDISCOVERY-ZINC04277952 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 72 0 0 1 0 0 0 0 0999 V2000 0.6290 3.0200 -0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 1.7660 -1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 0.6410 -0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 0.7700 -0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 2.0240 -0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 3.1490 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2350 -0.6650 -0.4630 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3370 -0.3010 0.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 -1.7450 -0.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 -0.9720 -1.9680 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5470 0.0830 -2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9430 -0.4240 -3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 -1.7560 -3.7090 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 -2.8110 -2.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7250 -2.3050 -2.5720 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1020 -2.2440 -3.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 -3.2520 -1.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 -3.4160 -0.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 -3.9160 -1.8990 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -4.8370 -0.9330 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1520 -5.3330 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 -5.8850 -1.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 -6.7370 -2.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -6.5550 -3.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -7.5260 -4.2520 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9480 -7.6020 -5.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 -8.3770 -3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 -7.9170 -2.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3150 -8.5910 -0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1170 -9.6940 -0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8150 -10.1500 -1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 -9.5040 -3.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -4.0650 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -2.8640 -0.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -4.7090 0.9830 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3130 -2.0060 -4.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1110 -3.0790 -5.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1120 -0.9740 -5.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9260 -0.0960 -4.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6540 0.8520 -5.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5540 0.9000 -6.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7790 0.0590 -7.6390 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0720 -0.8640 -7.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 3.9000 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 1.6650 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -0.3400 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8170 2.1250 -0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 4.1290 -0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9840 0.3180 -3.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 0.9750 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3980 0.2600 -3.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5650 -0.4890 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 -3.7030 -3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6800 -3.0460 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -3.7850 -2.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -6.5150 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -5.3850 -2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -5.7610 -4.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 -8.2420 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 -10.2150 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 -11.0230 -1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 -9.8650 -3.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -5.6690 1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -4.2120 1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9840 -0.1560 -3.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2920 1.5460 -5.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1210 1.6380 -7.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4520 -1.5380 -7.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 44 1 0 0 0 0 2 3 2 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 46 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 47 1 0 0 0 0 6 48 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 49 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 51 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 53 1 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 33 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 59 1 0 0 0 0 30 31 2 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 31 61 1 0 0 0 0 32 62 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 63 1 0 0 0 0 35 64 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 43 2 0 0 0 0 39 40 2 0 0 0 0 39 65 1 0 0 0 0 40 41 1 0 0 0 0 40 66 1 0 0 0 0 41 42 2 0 0 0 0 41 67 1 0 0 0 0 42 43 1 0 0 0 0 43 68 1 0 0 0 0 M END