IBS-ZINC02424396 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.5890 1.1620 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 0.4610 2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 0.9770 3.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 1.6690 3.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8330 2.0830 2.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2950 2.8300 3.2700 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.9500 2.6440 4.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 2.0200 5.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4210 1.8780 6.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2980 2.3270 7.4690 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4460 2.9070 7.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8350 3.1060 5.8160 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5400 3.5330 8.3440 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0220 2.5120 9.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8200 2.9200 10.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8490 2.3260 11.2980 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2450 3.9850 11.6590 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6710 4.5980 12.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7960 4.1940 13.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1440 4.8550 14.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3720 5.9180 15.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2440 6.3300 14.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8880 5.6750 13.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8000 5.9900 12.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 7.0830 12.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 1.3210 7.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 1.8910 1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 0.2480 -0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 1.0090 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 1.9930 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 0.2040 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -0.4150 2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 0.1270 4.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 1.6850 3.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2120 1.4540 9.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9540 2.6390 9.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4080 4.4130 11.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4190 3.3700 13.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0210 4.5370 15.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6480 6.4280 16.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6680 7.1600 14.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 8.0150 12.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5330 6.8800 13.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 7.2050 12.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 0.9690 6.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 1.2810 8.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 1.0680 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 2.8050 0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 1.5310 1.2900 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4450 2.3830 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 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 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END