IBS-ZINC04808404 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.7210 0.0730 1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 0.6330 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -0.1450 -1.5030 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7080 0.3270 -2.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -1.6170 -1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -2.4160 -2.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 -2.3230 -2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1810 -0.8780 -2.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 1.3640 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8270 1.6360 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1300 0.6530 0.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0590 3.0030 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1620 4.1600 -0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3110 5.2230 0.3470 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3970 4.7730 1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 3.3900 1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 2.6760 2.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 3.3440 4.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6220 4.7240 4.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5990 5.4600 2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 2.5260 5.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6520 3.1430 6.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3720 6.6190 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 4.3580 -2.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -0.8860 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -0.0650 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 0.7630 1.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 0.6590 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 1.6810 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -2.0970 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 -1.6750 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -3.4650 -2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -2.0380 -3.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -2.7970 -1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 -2.8770 -3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.8230 -2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 -0.4000 -3.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 2.0600 -1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 1.4190 -2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1290 1.5960 2.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7780 5.2730 4.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 6.5370 2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6330 3.6270 6.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8480 3.8520 6.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6270 2.3580 7.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 7.2580 0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3850 6.8280 -0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6390 6.8000 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 4.4020 -2.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6640 5.2760 -2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6720 3.5400 -2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -0.0730 -1.5310 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9260 -0.4850 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 52 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 52 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 9 52 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 23 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 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END