NIH-ZINC00245537 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -1.1930 -1.6210 0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -1.8770 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -1.0700 0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -1.3300 0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9310 -2.4050 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9390 -3.2350 -0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -2.9660 -0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 -4.3070 -1.6000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 -5.2500 -2.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -5.3510 -2.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 -6.1340 -2.9770 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -7.2950 -3.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -6.9760 -4.7200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9870 -6.0530 -5.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -8.0500 -5.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 -9.4210 -5.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -10.3520 -6.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -9.8850 -7.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -8.5760 -8.1230 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -7.6950 -7.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 -5.7010 -4.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 -5.2230 -4.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4670 -6.3310 -3.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 -7.1540 -2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -7.7360 -3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 -1.9020 -0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 -2.1990 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -0.5580 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -0.2340 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 -0.6970 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9830 -2.5830 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -3.5900 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3680 -4.3820 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3310 -5.9930 -3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 -7.7820 -4.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -7.9800 -2.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -9.7860 -4.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -11.4180 -6.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -10.5710 -8.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -6.6550 -7.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -6.2970 -5.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -4.8540 -5.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 -4.5880 -3.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 -4.6290 -4.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2990 -6.5700 -1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2710 -7.9670 -2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 -8.3250 -2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 -8.3410 -4.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 -6.5980 -4.0270 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3590 -6.0100 -3.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 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 1 0 0 0 0 13 15 1 0 0 0 0 13 49 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END