IBS-ZINC00493779 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -0.5940 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.7750 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0550 -0.1990 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7450 -1.0280 -1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 -1.8110 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 -3.1500 -0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3990 -2.8960 0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -2.1130 0.7220 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3220 -2.6890 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 -1.8710 2.1010 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.8080 2.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -3.8510 2.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -2.5580 4.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -3.7510 4.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -3.8100 4.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 -4.9040 4.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6950 -5.9390 5.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -5.8800 5.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -4.7830 5.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -0.0750 -1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -1.6040 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8220 -1.2360 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3810 -1.9920 -2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7880 -3.7070 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -3.7260 -1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 -2.3200 1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -3.8500 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -1.0360 2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -1.6740 4.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -2.3990 4.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1640 -3.0020 4.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 -4.9510 4.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 -6.7940 5.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -6.6880 6.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 -4.7350 5.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 M END