CHEMBRIDGE-ZINC00578805 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0400 1.5720 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 0.0700 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -0.6640 1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -2.0420 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -2.6900 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -1.9500 -0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -0.5730 -0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 0.2160 -1.8750 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5180 -0.2030 -2.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 1.2840 -2.2720 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1210 -4.0850 -0.1530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -4.8360 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -4.3020 2.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -6.3390 0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -6.9180 2.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -7.3500 2.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -7.8350 4.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -7.6750 4.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 -7.0920 3.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 -6.8100 2.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2130 -7.1010 3.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7720 -7.6750 5.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -7.9690 5.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 -8.3780 5.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 -8.4500 4.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 1.9970 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9410 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 1.8670 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -0.1600 1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -2.6140 1.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -2.4510 -1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -4.5130 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -6.6340 0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -6.6990 0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -7.3210 2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -6.3640 1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 -6.8810 3.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4780 -7.8970 5.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 -8.4140 6.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -8.7280 5.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END