CHEMBRIDGE-ZINC02842219 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 2.3520 -4.4580 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0800 -4.2630 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 -2.9820 -0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2160 -1.8780 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 -2.0910 1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 -3.3730 1.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -0.4900 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1430 -0.5620 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8270 -0.0270 0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0860 -0.8850 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4330 -1.4390 -0.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7690 -0.9100 2.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9400 -1.6380 2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5950 -2.4820 1.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7440 -3.1840 1.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2550 -3.0560 3.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6060 -2.2120 4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4540 -1.5030 3.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1330 -2.0690 5.4330 N 0 3 0 0 0 0 0 0 0 0 0 0 11.0670 -2.8110 5.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6170 -1.2140 6.1660 O 0 5 0 0 0 0 0 0 0 0 0 0 2.5560 0.5160 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 1.8590 -0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 1.9510 -1.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -5.4540 1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3140 -5.1070 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0820 -2.8480 -1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2350 -1.2590 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 -3.5220 2.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1430 0.9980 0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 -0.0170 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3860 -0.3450 2.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2320 -2.6200 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2370 -3.8340 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1480 -3.6130 3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9550 -0.8510 4.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 0.0750 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 0.7290 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 2.7240 -0.5580 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 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 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M CHG 1 39 -1 M END