IBS-ZINC02212640 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 -0.3890 2.1080 0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 0.6430 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.4820 -0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 0.1950 1.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -1.1500 1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 -1.9640 1.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 -1.5050 3.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -2.8010 3.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -2.7120 5.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 -3.7670 5.9180 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -4.9380 5.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -6.0830 6.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -7.3360 5.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -7.4460 4.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -6.3040 3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -5.0510 4.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -3.9930 3.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 -1.3910 5.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -0.6440 4.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 0.7070 4.2000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 -0.9120 6.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 0.1120 6.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7590 0.5660 7.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 0.0080 8.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -1.0240 8.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 -1.4880 7.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 0.4980 10.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 1.3750 9.9930 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4450 2.7080 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 2.5230 -0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 2.2170 1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 0.0770 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 1.0150 -0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -0.5700 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 0.8620 -1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 -5.9970 7.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 -8.2180 6.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -8.4150 3.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -6.3930 2.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 1.2190 3.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 1.2900 5.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 0.5370 5.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 1.3540 7.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 -1.4730 9.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 -2.2780 7.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 -0.0020 11.2360 O 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 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 19 2 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 2 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 2 0 0 0 0 M CHG 1 28 -1 M END