IBS-ZINC06624425 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 44 0 0 1 0 0 0 0 0999 V2000 -0.0310 1.4950 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 0.0200 -0.0800 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9780 -0.4210 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -0.8200 -1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -0.1900 -2.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -0.1040 1.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -0.2500 2.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 0.1390 2.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -0.0330 3.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -0.6050 4.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -1.0000 4.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -0.8080 3.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -1.5420 5.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.0970 6.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -2.5090 7.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -2.4130 8.5790 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 -1.8790 8.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -1.4570 6.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -0.8940 5.9560 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3020 -0.7100 6.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2090 -0.2010 5.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4910 -1.1370 7.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 -1.7160 8.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -2.1080 10.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8380 -1.9320 10.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 -1.3620 9.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7330 -0.9620 8.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 1.9410 -0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 1.6370 -1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 2.0650 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 0.6000 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2730 0.2770 3.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -1.1040 3.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 -2.2050 5.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 -2.9500 8.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 -2.5550 10.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9770 -2.2420 11.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8640 -1.2300 10.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5650 -0.5190 8.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -2.0660 -0.8490 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 40 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 33 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 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 36 1 0 0 0 0 25 26 2 0 0 0 0 25 37 1 0 0 0 0 26 27 1 0 0 0 0 26 38 1 0 0 0 0 27 39 1 0 0 0 0 M CHG 1 40 -1 M END