IBS-ZINC02122108 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -0.5120 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7010 -2.4550 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -1.9270 0.0390 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9570 -2.3360 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.5000 0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8950 -2.3510 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -2.5130 2.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 -4.0070 2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6820 -4.5580 1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 -5.9600 1.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7860 -6.4420 1.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -6.7770 2.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -6.2940 2.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -4.9050 2.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -4.3970 3.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 -5.2620 3.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 -6.6470 3.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -7.1560 3.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -7.5720 4.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 -7.4440 5.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0290 -8.3080 5.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -9.3000 4.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 -9.4320 3.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0040 -8.5700 3.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7610 -4.7730 4.3440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -0.1840 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -0.1150 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -2.0890 2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 -3.5450 1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3630 -1.9400 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4090 -1.9750 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9590 -3.4390 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -2.2800 3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4280 -2.0590 2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 -3.9240 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -3.3300 3.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -8.2240 2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 -6.6700 6.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4340 -8.2100 6.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2720 -9.9740 5.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3570 -10.2080 3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6070 -8.6710 2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4740 -4.5930 3.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -1.9810 1.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 50 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 50 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 50 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 41 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 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 28 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 M END