IBS-ZINC03977871 MOE2007 3D CORINA 3.40 0006 02.08.2006 79 83 0 0 1 0 0 0 0 0999 V2000 0.4020 1.5090 -0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -0.0280 -0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -0.5500 0.5190 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8260 -1.6310 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -0.1190 1.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -0.7990 3.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -0.6540 3.4120 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9230 -1.1360 2.1260 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0010 -1.0000 2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 -0.3740 0.7650 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3530 -0.9270 -0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 -0.4280 -1.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -0.6520 -1.9950 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1750 -1.7350 -2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -0.1690 -3.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 0.7530 -3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 1.1140 0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 -2.6670 2.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 -3.2630 0.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 -3.5000 3.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -2.9990 4.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 -1.5240 4.7310 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8960 -0.9550 5.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 -1.7780 6.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6540 -3.2830 6.2240 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3260 -3.8480 5.6420 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5400 -3.7190 6.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 -5.3800 5.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7810 -6.1520 6.7250 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0360 -5.5510 7.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 -4.0290 7.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -6.1940 7.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0320 -7.6620 6.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 -8.1050 5.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8450 -3.4350 5.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 -1.4540 5.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 0.8440 3.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 -0.5310 -1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 1.9730 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 1.8150 -1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 1.9560 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 0.9680 1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -0.3810 1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.3710 3.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -1.8600 3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4150 -0.6660 -0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 -2.0150 -0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 0.6250 -1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3880 -0.9570 -2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 1.7750 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8790 1.2200 1.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 1.5410 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 -4.5410 2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6690 -0.8530 4.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7260 0.0520 5.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4310 -1.3380 6.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8150 -1.6590 7.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 -5.7380 5.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1420 -5.6200 4.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1940 -5.9890 8.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9260 -5.8230 6.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 -3.6790 7.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 -3.7820 8.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 -6.6390 7.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 -6.7930 8.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -5.1960 8.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7650 -3.0350 5.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0450 -4.4780 4.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6840 -2.8980 4.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -2.0500 5.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 -1.8250 6.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -0.4280 5.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0360 1.0810 4.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4300 1.1120 3.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 1.5400 3.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.3060 -2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -1.6160 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 -0.0560 -0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -8.2880 7.2650 O 0 5 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 3 1 0 0 0 0 2 13 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 18 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 26 1 0 0 0 0 25 31 1 0 0 0 0 25 35 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 29 32 1 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 32 66 1 0 0 0 0 33 34 2 0 0 0 0 33 79 1 0 0 0 0 35 67 1 0 0 0 0 35 68 1 0 0 0 0 35 69 1 0 0 0 0 36 70 1 0 0 0 0 36 71 1 0 0 0 0 36 72 1 0 0 0 0 37 73 1 0 0 0 0 37 74 1 0 0 0 0 37 75 1 0 0 0 0 38 76 1 0 0 0 0 38 77 1 0 0 0 0 38 78 1 0 0 0 0 M CHG 1 79 -1 M END