IBS-ZINC01789851 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -2.6830 -2.9850 -0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0450 -2.2490 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 -2.7880 1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 -2.1320 2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 -1.0770 2.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -0.1740 1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -0.9200 -0.0400 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4270 -1.0800 -0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1240 -0.9220 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 0.3070 -0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5980 1.3120 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8360 1.7360 0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9890 1.1580 0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8980 0.1540 -0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 -0.2670 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2080 1.5760 0.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3530 0.9380 0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 0.1950 -2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 0.9270 -2.8600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 -0.3570 -2.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 0.0150 -4.0890 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2440 1.1460 -4.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 1.5300 -5.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 0.7090 -6.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -0.4720 -6.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -0.7920 -5.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1030 -3.9250 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4770 -2.3730 -1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 -3.1910 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 -3.7500 1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 -1.7240 3.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -2.8720 3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 0.1690 1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 0.6800 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7000 1.7610 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9080 2.5170 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7950 -0.2960 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5890 -1.0460 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2590 1.3640 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3550 1.0930 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3170 -0.1310 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 0.0530 -2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -1.4430 -2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 1.7800 -3.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 2.4580 -5.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 0.9840 -7.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 -1.1360 -7.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 -1.7130 -4.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 M CHG 1 21 1 M END