IBS-ZINC02321281 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 -1.0020 3.2390 0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 3.7550 1.6690 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2230 3.0950 1.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2730 3.5450 2.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4780 2.8780 2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6440 1.7470 1.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5860 1.2980 0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3870 1.9740 0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9330 1.0290 1.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8520 1.4210 2.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0920 -0.0610 0.8560 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2690 -0.7160 0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5630 -0.1650 1.8230 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.4280 -1.8060 0.0700 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6180 -2.5390 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8410 -1.8810 0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0150 -2.6070 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9730 -3.9870 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7570 -4.6460 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5800 -3.9260 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4720 -4.9100 0.3140 S 0 0 0 0 0 0 0 0 0 0 0 0 -13.1480 -6.1560 0.9140 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.4600 -4.0300 0.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.9180 -5.2440 -1.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.1250 -6.0630 -2.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4900 -6.3500 -3.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6640 -7.1760 -4.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5570 -7.6620 -3.5410 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2400 -7.3680 -2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9990 -6.5810 -1.5470 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1050 -7.8820 -1.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3160 -8.7220 -2.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9800 -7.4830 -5.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.0780 -8.3380 -6.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 3.8580 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 2.2160 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 3.2490 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1430 4.4180 3.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2920 3.2280 3.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7110 0.4250 0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 1.6310 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3580 -0.3730 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7160 -2.0830 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8740 -0.8020 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9660 -2.0960 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7280 -5.7240 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6300 -4.4410 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7350 -4.8670 -1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3960 -5.9420 -3.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 -8.1590 -3.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4380 -9.0660 -2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9080 -9.5810 -2.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0950 -7.8700 -6.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0020 -9.2940 -5.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4490 -8.5040 -7.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 41 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 42 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 33 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 33 34 1 0 0 0 0 34 53 1 0 0 0 0 34 54 1 0 0 0 0 34 55 1 0 0 0 0 M END