IBS-ZINC02128937 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 -1.2230 -0.8970 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -0.2170 1.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 0.3410 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 -0.7240 1.0440 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6330 -1.7210 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1190 -0.7900 2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3020 -1.8200 3.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8100 -1.8870 4.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0270 -2.8730 5.4580 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2990 -3.1020 6.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1940 -2.4910 7.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 -4.0100 7.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4920 0.1980 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0210 1.1790 -0.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -0.1440 -2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -0.5240 -3.5410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 -1.2920 -3.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 -1.7000 -4.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 -2.4790 -4.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1610 -2.8650 -3.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5950 -2.4760 -2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 -1.6860 -2.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -1.2350 -1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 -1.5360 0.0040 O 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 -4.0130 0.1880 2.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1690 -1.0820 2.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4070 -2.7990 2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -1.5280 3.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7040 -0.9080 5.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8600 -2.1790 4.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -3.3610 5.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 -4.4980 7.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 -4.1750 8.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 0.4660 -2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0320 -1.4060 -5.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 -2.7940 -5.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0520 -3.4770 -3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0390 -2.7790 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8010 -0.0690 0.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3270 0.5520 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 19 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 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 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 47 48 1 0 0 0 0 M END