IBS-ZINC02140498 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 -0.0480 1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5800 -0.8430 2.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -1.9980 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -2.4750 0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -2.6840 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -2.0880 -0.9140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 -4.1910 -0.4900 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5560 -4.5380 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 -4.7080 0.9520 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1860 -4.2390 1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -6.2450 0.9450 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7140 -6.5980 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6030 -6.7710 0.0360 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4420 -7.8370 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -6.0650 -1.3320 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8920 -6.4210 -2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 -4.6760 -1.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0070 -6.3960 -1.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7900 -6.3520 -0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9250 -6.5710 0.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4420 -4.9760 -0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8750 -7.4300 -0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -6.6470 0.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -5.6990 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -4.4850 1.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -5.3750 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -6.2900 2.4780 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1090 -4.8020 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0140 -4.9370 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6690 -4.2070 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4100 -8.4080 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4500 -7.4110 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5380 -7.2380 -1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -4.9480 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 -4.6570 0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -6.2880 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -7.2060 2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 -5.5710 2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 -6.5160 3.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2770 1.2690 1.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7370 1.5330 2.2820 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 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 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 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 52 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 22 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 30 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 28 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 25 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 31 46 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 32 49 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 52 53 1 0 0 0 0 M END