CHEMBRIDGE-ZINC01127129 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 0.2020 1.2900 -0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -0.0790 0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -0.6590 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 0.0730 1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 -0.5180 2.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8530 -1.8400 3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 -2.5770 2.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -1.9880 1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 -2.7090 0.6900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -4.5800 2.9720 I 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 -2.4800 4.3890 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9400 -3.2870 4.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8520 -3.0950 3.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0300 -2.6700 4.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0380 -1.7210 5.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9280 -1.1540 5.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0790 0.0190 7.1380 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -1.4720 5.4540 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3060 -3.2390 3.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5780 -3.3050 2.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7730 -3.8370 2.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7010 -4.3050 3.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4390 -4.2430 4.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2500 -3.7080 4.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 -4.0680 2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 -3.7330 1.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0110 -5.4980 3.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9040 -6.4720 2.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0710 -7.8030 2.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3430 -8.1720 3.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 -7.2110 4.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 -5.8760 4.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 1.3880 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 1.6290 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 1.8980 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 1.1060 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 0.0540 3.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -3.1740 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8930 -1.4460 5.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 -1.0440 5.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8540 -2.9400 1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9840 -3.8890 1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6350 -4.7210 2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1680 -4.6100 5.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0490 -3.6560 5.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 -6.1850 1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 -8.5580 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 -9.2150 4.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6620 -7.5060 5.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3790 -5.1260 5.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 9 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 30 31 2 0 0 0 0 30 48 1 0 0 0 0 31 32 1 0 0 0 0 31 49 1 0 0 0 0 32 50 1 0 0 0 0 M END