NIH-ZINC04039051 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 1 0 0 0 0 0999 V2000 -1.8680 0.8840 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -0.3390 0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -0.7910 1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -2.0140 0.8380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 -2.9480 1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 -4.0710 0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -4.2890 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -3.3940 -1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 -2.2020 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -1.2090 -0.5770 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -0.2880 2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 0.4860 2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 0.9930 1.5100 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9810 0.1370 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5420 1.6920 2.2620 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 1.7400 3.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 2.2950 4.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 0.9730 3.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 0.7690 4.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7230 2.2820 1.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6060 3.8060 1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8400 5.9900 1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2320 6.6180 1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9350 6.2530 0.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1220 4.8380 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7790 4.1110 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 1.8910 0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8930 1.5780 -0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 2.4250 -1.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 3.5710 -1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 3.9140 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 3.0660 0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -0.6590 3.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 1.4750 -0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9240 0.6150 0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 1.5150 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -2.7390 2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 -4.8270 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -5.2050 -1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -3.5600 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5710 2.0490 2.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9040 1.7920 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0660 4.0770 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0860 4.2440 2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3210 6.2140 2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2400 6.3150 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1460 7.7090 1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8210 6.3190 2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6830 4.6320 -0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7320 4.4990 1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1840 4.4190 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9240 3.0270 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 0.6690 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 2.1910 -2.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 4.2630 -2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 3.3800 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -0.2580 4.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9690 4.4720 1.4280 N 0 3 0 0 0 0 0 0 0 0 0 0 6.4960 4.1640 2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 27 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 58 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 58 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 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 58 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 2 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END