IBS-ZINC02234845 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 65 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.8060 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -0.3060 1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 0.7200 2.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 0.5360 3.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 1.5480 4.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 2.9530 4.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 3.7230 5.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 3.0980 6.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 1.7820 6.3150 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1620 0.9890 5.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 -0.7660 5.2860 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -0.7590 3.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -1.8270 2.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -1.5600 1.8630 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0320 -3.1390 3.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -4.0800 2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 -5.5110 2.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 -4.8390 5.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -3.4080 4.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -7.1700 4.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -7.4840 5.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 -7.4200 5.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 3.9260 7.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 3.4850 8.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8060 4.2600 9.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3930 5.4700 9.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4080 5.9120 7.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8430 5.1440 6.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 5.1880 4.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 5.2150 3.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 3.8270 3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1830 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1670 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1570 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -3.9710 2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -3.8680 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -6.2120 2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 -5.6270 2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 -4.9480 5.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -5.0500 6.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 -2.7060 5.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -3.2910 4.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 -7.3060 4.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -7.8420 3.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 -8.4850 6.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -6.7570 6.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -7.6090 6.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 2.5400 8.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 3.9190 10.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8400 6.0730 10.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8680 6.8590 7.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8600 5.4880 5.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 5.7260 5.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6830 5.6240 4.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 5.3220 4.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 6.0110 3.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 3.8900 2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 3.4370 2.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -5.7800 4.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 15 2 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 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 20 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 60 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 60 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 60 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 M END