IBS-ZINC02212721 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 65 0 0 1 0 0 0 0 0999 V2000 1.3100 1.3710 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 0.0720 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -0.6870 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -1.8540 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 -2.2430 0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 -1.4620 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -0.3150 -1.0920 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -1.8520 -2.1910 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -1.0450 -3.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 -1.9160 -4.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 -3.9490 -3.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -3.0670 -2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7230 -3.9810 -5.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 -5.0280 -6.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9840 -4.6680 -6.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9700 -5.6260 -7.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7140 -6.9280 -6.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 -7.2870 -6.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 -6.3690 -5.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4810 -8.6140 -5.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7690 -9.0490 -6.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5540 -7.9840 -6.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -2.8030 2.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -2.0610 3.6130 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8900 -1.3520 3.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -1.2680 3.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -0.3230 2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 0.6970 2.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -3.0020 4.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -3.0620 5.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 -4.1950 6.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.7540 5.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -4.0360 4.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.2220 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 1.7960 -1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 2.1050 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 -0.6140 -3.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 -0.2060 -3.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 -1.3540 -5.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -2.2760 -4.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -4.3280 -3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6500 -4.7840 -3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 -3.6700 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 -2.7860 -2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -4.4230 -5.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6570 -3.2900 -6.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1730 -3.6360 -7.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9050 -5.3580 -7.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -6.6940 -5.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6140 -9.8220 -7.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3280 -9.4850 -5.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -3.3300 2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -3.5620 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 -0.6710 4.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 -1.9260 3.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 -2.3710 6.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -4.5600 7.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -5.6160 6.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 -3.1490 -4.6950 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.0020 -2.8230 -4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 59 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 11 59 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 13 59 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 29 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 2 0 0 0 0 29 30 2 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 32 2 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 32 58 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 59 1 M END