IBS-ZINC02139946 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.1510 0.8190 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 1.0720 2.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 2.0610 3.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 2.2720 3.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0460 2.8410 4.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4110 3.0580 4.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0890 2.7020 3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3920 2.1330 2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0200 1.9160 2.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 1.2870 1.3090 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5100 0.2160 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8280 1.9080 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 3.4090 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 3.9270 1.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 4.2450 -0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 3.6530 -2.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 4.4440 -3.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3200 5.8240 -3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7040 6.4230 -1.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1830 5.6450 -0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5830 6.2320 0.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0510 1.7840 1.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7160 0.5200 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4100 3.0140 3.5880 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4620 3.9350 4.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3050 3.5910 5.4790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -0.2470 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 0.9690 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 1.2240 -0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 1.0570 2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 0.0760 2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 1.6660 4.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3510 3.0130 3.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 3.1160 5.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2320 1.5480 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 1.6260 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 2.5780 -2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 3.9860 -3.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7280 6.4360 -3.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6320 7.4990 -1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 6.3740 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0060 -0.2650 1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5250 0.5330 1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1260 0.3260 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3920 4.9630 4.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3750 3.7890 5.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 1.5080 1.4070 N 0 0 0 0 0 0 0 0 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 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 47 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 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 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 M END