NIH-ZINC04042849 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 68 0 0 1 0 0 0 0 0999 V2000 -0.3950 1.2320 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -0.2420 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -1.0220 1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -2.3970 0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 -2.9900 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -2.2190 -1.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -0.8480 -1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -0.0100 -2.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 -0.5710 -3.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 0.5410 -4.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 1.2790 -5.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 2.3250 -6.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 2.6480 -6.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 1.9290 -6.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 0.8830 -5.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -3.1610 2.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -4.6630 2.2240 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7360 -5.1640 3.5010 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1280 -4.3250 4.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -5.8180 4.3250 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -6.0030 3.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 -6.5760 4.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -5.3640 2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 -5.4090 1.4610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -6.2310 5.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -7.7300 5.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -7.6350 8.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -9.7170 7.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -6.1100 3.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1810 -5.7880 3.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2100 -6.6740 3.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0370 -7.8420 2.6570 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7830 -8.1330 2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 -7.3140 2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -2.5550 3.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 1.8080 -0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 1.4820 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 1.5430 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 -0.5500 1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -4.0450 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -2.7240 -2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -1.0190 -3.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -1.3430 -3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 1.0460 -4.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 2.8910 -6.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 3.4640 -7.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 2.1870 -6.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9260 0.3380 -5.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -6.0050 6.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -5.6190 6.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -7.9750 5.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -8.3140 5.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 -7.9040 7.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 -6.5510 8.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -8.0500 9.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -10.0830 6.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 -10.0840 6.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -10.0110 8.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -4.8650 4.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2320 -6.4580 3.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6750 -9.0740 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -7.6280 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -4.9770 1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -8.2100 7.2700 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7540 -7.9110 7.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 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 39 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 2 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 35 2 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 17 63 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 29 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 64 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 64 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 64 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 59 1 0 0 0 0 31 32 1 0 0 0 0 31 60 1 0 0 0 0 32 33 2 0 0 0 0 33 34 1 0 0 0 0 33 61 1 0 0 0 0 34 62 1 0 0 0 0 64 65 1 0 0 0 0 M CHG 1 64 1 M END