IBS-ZINC00545365 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -0.5120 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -0.0980 2.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -0.6250 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 -0.1150 1.1740 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1590 0.9710 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.5000 0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4860 -0.7230 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -0.4950 3.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -0.2030 4.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -0.6300 5.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -0.1970 7.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 0.4660 6.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 0.4510 5.2930 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 0.8440 4.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 0.9900 7.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 0.8580 8.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 0.2060 9.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -0.3230 8.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -0.9630 9.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -1.0530 10.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -1.2910 5.8150 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 -1.5420 4.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -1.1630 3.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.6000 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -0.0900 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -1.7140 2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -0.2850 3.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0520 -0.4320 1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9970 -0.3600 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -1.8090 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8390 1.5020 7.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 1.2680 9.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 0.1100 10.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -0.0510 10.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -1.5910 10.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 -1.5870 10.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3970 -2.0790 4.4980 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 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 26 2 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 21 2 0 0 0 0 15 16 1 0 0 0 0 15 18 2 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 M END