IBS-ZINC02212495 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -2.5000 -2.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 -2.7640 -2.5840 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1580 -3.5420 -1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 -3.2270 -3.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9870 -3.6520 -4.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 -3.8830 -6.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -4.1960 -6.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -3.6240 -5.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -3.2180 -4.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -2.7670 -3.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -2.6500 -3.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4440 -3.8300 -4.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3410 -3.0330 -5.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7000 -3.2020 -5.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1760 -4.1620 -4.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2960 -4.9570 -3.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 -4.7940 -3.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0640 -5.5710 -3.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 -1.5030 -2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 -0.2930 -2.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 0.8670 -2.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0740 0.8180 -1.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5310 -0.4000 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8100 -1.5580 -1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6810 -0.4530 -0.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0900 -1.7370 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7760 1.9580 -1.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2470 3.1710 -2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9730 -2.2840 -6.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3940 -2.5850 -5.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2410 -4.2890 -4.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6750 -5.7040 -3.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 -6.3930 -3.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 -0.2540 -3.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5450 1.8110 -2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 -2.5030 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3160 -2.1470 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2460 -2.4050 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0200 -1.6380 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2520 3.3480 -1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9010 4.0020 -1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1830 3.0900 -3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 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 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 M END