IBS-ZINC04812944 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 41 0 0 0 0 0 0 0 0999 V2000 -0.1020 0.8190 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 1.0980 2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 3.0230 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7690 3.4440 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 4.9660 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7720 5.3530 -1.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0960 6.6400 -1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 7.0410 -2.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 8.4840 -2.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 9.3490 -1.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8300 8.8050 -3.6850 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4190 7.9540 -4.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0650 8.4180 -5.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2290 6.5950 -4.3610 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4950 6.0530 -3.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 4.8430 -3.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8390 5.6620 -5.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8660 5.3860 -6.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2260 4.2230 -6.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -0.2550 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 1.2060 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 1.0060 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 1.4450 2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 0.0090 2.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 1.5520 3.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 3.3720 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 3.4160 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 3.0940 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 2.9850 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 5.3320 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 5.4290 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2010 4.6280 -1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 7.3750 -0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 9.7910 -3.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1210 4.7370 -4.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7570 6.0880 -5.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7010 6.1900 -7.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3580 3.3910 -5.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 4.0850 -7.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 1.5110 1.4220 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7670 1.1760 1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 40 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 15 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 34 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 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END