IBS-ZINC03068353 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 43 0 0 1 0 0 0 0 0999 V2000 0.1660 1.3560 -0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -0.0750 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -0.4200 1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -1.7760 1.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 -2.2900 2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -3.6170 2.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -4.2670 3.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -3.5950 4.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 -2.2620 4.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -1.6130 3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6930 -4.3210 5.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -5.2230 6.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9510 -3.9400 6.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7030 -4.4870 7.4260 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4820 -5.5550 7.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4160 -3.7210 8.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0110 -3.9250 9.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 -5.3700 9.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 -2.9880 10.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2330 -4.2970 7.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5090 -3.4000 6.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 1.5230 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 1.5750 -1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 2.0650 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 -0.2320 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 -0.7670 -1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 -0.3030 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 0.2460 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -4.1500 2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -5.3000 4.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 -1.7020 5.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 -0.5800 3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5020 -3.2540 5.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1570 -3.9980 9.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5620 -2.6470 8.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 -3.6560 8.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 -5.4750 10.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8030 -6.0620 8.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 -5.6910 10.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 -1.9420 10.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -3.0950 10.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 -3.2020 11.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9960 -5.0500 7.8490 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 M CHG 1 43 -1 M END