IBS-ZINC05298451 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.3010 1.5430 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -0.2180 -0.3980 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -0.5460 1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -2.0070 1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 -2.3340 2.7570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0560 -2.0090 3.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 -3.8850 2.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6740 -4.4120 1.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 -1.6940 2.9330 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -1.4770 4.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7940 -2.2140 4.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4090 -3.1820 3.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 -3.8820 4.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 -3.6300 5.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4790 -2.6850 6.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3470 -1.9770 5.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 -0.3870 6.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1070 -0.5220 5.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 0.3210 4.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 1.2370 5.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 1.3360 6.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2500 0.5290 7.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 2.0960 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 1.9330 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 1.6960 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6270 0.1170 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.3130 2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 -2.6550 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -2.2320 0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 -1.5060 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 -3.4140 2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9870 -4.6250 3.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9630 -4.1700 5.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9030 -2.4970 7.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 0.2720 3.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 1.8660 5.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 2.0420 7.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 0.6220 8.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -4.4460 3.6670 O 0 5 0 0 0 0 0 0 0 0 0 0 4.8280 -1.0940 6.7000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 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 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 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 40 2 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 M CHG 1 39 -1 M END