IBS-ZINC05164439 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 0 0 1 0 0 0 0 0999 V2000 -2.3540 0.9130 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -0.5190 -0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2810 -1.3280 0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 -2.6400 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -3.1490 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -2.3350 -1.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -1.0240 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -2.8820 -2.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 -4.4780 -0.2530 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -5.0570 0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -4.4540 1.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -6.4530 0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 -6.2170 2.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 -6.5400 4.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -8.0580 4.6630 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7220 -8.4070 6.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 -9.9270 6.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -10.5700 5.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -10.2120 4.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -8.6920 4.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4290 -8.3220 4.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 -8.3150 2.5300 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4450 -8.7550 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 -8.8320 1.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 -7.9500 1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -8.4230 0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 -9.7800 0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 -10.6610 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 -10.1860 1.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0680 -10.2430 -0.0090 F 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 -8.5630 4.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 1.5500 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 1.2250 -1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3290 0.9980 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -0.9320 1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 -3.2710 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -0.3910 -2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -3.3060 -3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -2.0780 -2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -3.6580 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 -4.9840 -1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -7.1430 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -6.4760 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 -5.1370 2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -6.5920 2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 -6.0850 4.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -6.1510 4.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 -7.9520 6.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -8.0300 6.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -10.3020 5.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8010 -10.1790 7.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -11.6530 5.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -10.2030 6.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -10.5820 3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 -10.6670 3.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 -6.8920 1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3540 -7.7340 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 -11.7200 1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -10.8730 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 -8.1990 4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -6.8520 2.4020 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 12 61 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 13 61 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 61 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 57 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 29 59 1 0 0 0 0 31 60 1 0 0 0 0 M END