IBS-ZINC01790254 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.5480 0.6850 -1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -0.6810 -1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -0.8890 0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -2.1420 0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -3.1910 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -2.9900 -1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -1.7330 -1.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -1.5270 -3.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 -1.7020 -4.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -2.0380 -3.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -1.4720 -5.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -1.6260 -6.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 -1.3990 -7.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 -1.0170 -8.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -0.8600 -7.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -1.0840 -5.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -0.9380 -5.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 -1.1440 -3.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7330 -0.9250 -2.7360 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9860 -0.4390 -3.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2960 -0.1920 -3.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3740 -0.3300 -2.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3800 0.1840 -3.9510 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5980 0.4140 -3.2970 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6100 0.8880 -3.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3890 1.6200 -5.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1060 2.0510 -5.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9040 2.7350 -6.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9750 2.9960 -7.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2530 2.5700 -7.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4650 1.8910 -6.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7720 3.6710 -8.7490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 1.2570 -1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 0.5820 -2.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 1.2060 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 -0.0720 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -2.3020 1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -4.1690 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -3.8090 -1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -1.9230 -5.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 -1.5180 -8.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -0.8430 -9.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 -0.5630 -7.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1120 -1.2360 -4.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 0.4730 -4.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3180 0.2950 -4.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6130 0.7470 -3.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2720 1.8480 -4.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9130 3.0680 -7.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0830 2.7750 -7.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4590 1.5640 -5.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8570 4.6300 -8.6660 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 51 1 0 0 0 0 32 52 1 0 0 0 0 M END