IBS-ZINC04863046 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 0 0 0 0 0999 V2000 -2.5320 1.3340 2.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7010 -0.1400 2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1030 -0.3100 1.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -0.6280 1.4180 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6340 -0.0740 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -0.3990 2.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -1.3910 2.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 -2.0650 1.1090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 -2.6090 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0740 -1.9950 -0.7800 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 -4.1000 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2990 -4.8460 0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5520 -4.3600 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5530 -3.8120 0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7570 -3.3890 0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9800 -3.5110 2.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9780 -4.0550 3.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7710 -4.4800 2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2060 -3.0720 2.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4700 -3.1570 4.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -4.7150 -0.4710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -4.0910 -1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.8950 -1.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -4.9960 -1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -4.5630 -1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3770 -5.3900 -1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 -6.6420 -2.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 -7.0660 -2.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -6.2430 -2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 1.6780 3.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 1.4870 3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 1.9770 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6590 -0.7380 3.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 -1.3640 1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8670 0.0970 2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1920 0.2030 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -2.6570 1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2110 -5.9290 0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4020 -3.7010 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5240 -2.9540 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1000 -4.1630 4.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0020 -4.9020 3.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4760 -2.7620 4.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4580 -4.1970 4.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7680 -2.5420 4.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -5.7210 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 -3.5870 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 -5.0580 -1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9550 -7.2840 -2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6230 -8.0360 -2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -6.5780 -2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 0.7190 1.8790 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 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 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 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 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 M CHG 1 52 -1 M END