IBS-ZINC04028361 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 0.6010 0.3570 0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 1.8800 2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 3.1320 3.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 2.8760 3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5650 3.5760 4.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9050 3.2910 4.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5400 2.3460 3.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8560 1.6430 2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 1.9390 2.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 1.2470 1.2490 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8230 0.1650 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 1.6510 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 3.1260 -0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 3.4960 -0.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 4.8580 -0.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 3.9980 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3520 5.0600 0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4960 5.8210 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 5.5900 -0.7880 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2170 4.5530 -1.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 3.7280 -1.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 0.6600 1.7720 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7490 0.3520 1.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8530 2.2320 3.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9680 3.2000 4.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7310 3.8800 5.2390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -0.5250 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 0.6590 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 0.1690 -0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 2.0770 2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 1.0270 3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 3.4180 4.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 3.9680 2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 4.3130 4.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 1.0760 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3070 1.4260 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 4.9580 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 5.2900 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6990 6.6640 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9880 4.4000 -2.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9900 2.9120 -2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9720 -0.4240 1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9870 -0.0590 2.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3700 1.2210 1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7240 3.9410 4.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2990 2.6870 5.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 1.4910 1.2580 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0330 2.3170 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 47 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 15 37 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 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END