NCID-ZINC05208910 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 70 0 0 1 0 0 0 0 0999 V2000 -0.8030 1.5630 -0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 0.0930 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -0.1460 1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 -0.7630 -0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -0.3850 -1.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 0.1540 -1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 1.0530 -0.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 -0.4700 -2.2460 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9740 -0.1290 -2.5020 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4630 0.0400 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1080 1.1340 -3.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 0.9150 -4.7240 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4460 0.4850 -5.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6310 -1.3260 -3.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9970 -2.3190 -3.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9760 -1.1460 -3.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6680 -1.9690 -4.4370 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2480 -2.9810 -4.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1870 -1.9970 -4.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5800 -2.4120 -2.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1760 -3.6430 -2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5100 -3.9920 -0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2590 -3.1260 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6940 -1.9130 -0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3550 -1.5590 -2.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4990 -3.5840 1.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0960 -2.6700 2.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1440 -3.3350 3.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2910 -4.0260 3.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3230 -4.6590 5.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2090 -4.6130 5.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0590 -3.9400 5.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0240 -3.3070 4.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3290 -1.3380 -5.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7210 -0.2680 -5.9110 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 -2.0750 -6.8850 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5210 -1.6730 -8.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 -2.6970 -9.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7280 -3.6520 -8.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 2.2280 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 1.7290 -1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6890 1.8820 -0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 0.0630 1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -1.1830 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 0.4880 1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9790 -0.6460 -1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 -1.8280 -0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 -0.4950 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 -1.2110 -2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 1.9450 -2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1430 1.4920 -3.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4960 -0.4110 -2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6670 -2.6840 -4.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6040 -1.0050 -4.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5870 -4.3380 -2.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1710 -4.9420 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2980 -1.2170 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6980 -0.6040 -2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1140 -2.4150 1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5070 -1.7470 2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1650 -4.0800 3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2170 -5.1910 5.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2350 -5.1080 6.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1870 -3.9110 6.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1160 -2.7960 3.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2430 -2.9630 -6.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4420 -1.5570 -8.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0020 -0.7010 -8.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8300 -2.4590 -10.4820 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 43 1 0 0 0 0 3 44 1 0 0 0 0 3 45 1 0 0 0 0 4 46 1 0 0 0 0 4 47 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 34 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 25 58 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 59 1 0 0 0 0 27 60 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 61 1 0 0 0 0 30 31 1 0 0 0 0 30 62 1 0 0 0 0 31 32 2 0 0 0 0 31 63 1 0 0 0 0 32 33 1 0 0 0 0 32 64 1 0 0 0 0 33 65 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 37 1 0 0 0 0 36 66 1 0 0 0 0 37 38 1 0 0 0 0 37 67 1 0 0 0 0 37 68 1 0 0 0 0 38 39 2 0 0 0 0 38 69 1 0 0 0 0 M CHG 1 69 -1 M END