CHEMBRIDGE-ZINC02824139 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 -0.0030 1.7330 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 0.2080 -0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4980 -0.1660 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -0.3400 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 -0.6750 2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1270 -0.0810 1.1010 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2770 0.9970 1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 -0.3160 -0.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 -0.7250 0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -0.6010 3.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -0.0010 4.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -0.4300 6.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 0.1720 7.3390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -0.0830 8.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -0.8810 8.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 -1.0820 10.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -0.4910 11.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 0.3100 10.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 0.5010 9.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 1.3350 9.4390 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7770 2.5030 9.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 0.8190 9.6200 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0200 2.1090 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 2.0660 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 2.2050 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -1.4270 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 0.1350 1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -0.4310 3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -1.7600 2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1490 -0.5700 1.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9710 -0.3020 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3920 -1.8020 0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 -0.2970 3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -1.6950 3.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 1.0950 4.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 -0.2990 5.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -1.5230 6.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 -0.0800 6.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 -1.3670 8.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 -1.7070 10.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -0.6570 12.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 0.7710 11.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -0.0860 2.4900 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1430 0.9330 2.5980 H 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 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 9 32 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 10 43 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 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M CHG 1 43 1 M END