IBS-ZINC02095922 MOE2007 3D CORINA 3.40 0006 02.08.2006 73 77 0 0 1 0 0 0 0 0999 V2000 0.9380 -3.1030 -0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -3.4120 0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 -3.8490 0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -4.2790 2.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 -4.8180 2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5800 -6.1520 2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8950 -6.6310 2.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 -7.8280 2.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9220 -5.8010 2.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7420 -4.4660 2.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 -3.9210 2.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2660 -2.5340 2.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3510 -1.7160 3.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6140 -2.2610 3.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8150 -3.6220 3.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7860 -1.3560 3.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 -2.0000 2.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -1.6020 3.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 -1.7890 4.9290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -0.9230 3.7460 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6260 -1.5390 3.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 0.4420 3.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 1.0900 2.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 1.9470 3.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 2.3250 3.2780 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 2.9380 3.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 1.7060 2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 0.9000 1.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 0.1420 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0800 0.1830 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 0.9730 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2400 1.7360 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -0.7400 5.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -1.8280 5.6850 S 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 -1.3640 6.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -3.1190 5.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 -1.7080 4.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0960 -0.8900 5.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 -0.7960 4.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3250 -1.5200 3.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2820 -2.3380 2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1480 -2.4350 3.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5640 -1.4160 2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 -2.7920 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -3.9960 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -2.3020 -1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -4.2130 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -2.5190 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -3.0170 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -4.6860 0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -5.0540 2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 -3.4200 2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -6.8420 2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 -0.6480 3.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8050 -4.0330 3.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2360 -1.0410 2.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5240 -1.8930 4.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4430 -0.4790 4.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 0.3100 2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 1.0760 3.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 2.2870 4.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -0.4760 0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 -0.4040 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0140 0.9950 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 2.3460 1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 0.0180 5.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0230 -0.3250 6.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0470 -0.1570 4.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 -2.9020 1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 -3.0770 3.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3170 -2.1130 2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3150 -1.6600 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9550 -0.4000 2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 1 46 1 0 0 0 0 2 3 1 0 0 0 0 2 47 1 0 0 0 0 2 48 1 0 0 0 0 3 4 1 0 0 0 0 3 49 1 0 0 0 0 3 50 1 0 0 0 0 4 5 1 0 0 0 0 4 51 1 0 0 0 0 4 52 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 53 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 55 1 0 0 0 0 16 56 1 0 0 0 0 16 57 1 0 0 0 0 16 58 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 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 59 1 0 0 0 0 22 60 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 61 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 62 1 0 0 0 0 30 31 2 0 0 0 0 30 63 1 0 0 0 0 31 32 1 0 0 0 0 31 64 1 0 0 0 0 32 65 1 0 0 0 0 33 34 1 0 0 0 0 33 66 1 0 0 0 0 34 35 2 0 0 0 0 34 36 2 0 0 0 0 34 37 1 0 0 0 0 37 38 1 0 0 0 0 37 42 2 0 0 0 0 38 39 2 0 0 0 0 38 67 1 0 0 0 0 39 40 1 0 0 0 0 39 68 1 0 0 0 0 40 41 2 0 0 0 0 40 43 1 0 0 0 0 41 42 1 0 0 0 0 41 69 1 0 0 0 0 42 70 1 0 0 0 0 43 71 1 0 0 0 0 43 72 1 0 0 0 0 43 73 1 0 0 0 0 M END