SIAL-ZINC02560989 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 27 0 0 1 0 0 0 0 0999 V2000 -0.0410 1.4980 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0250 -0.0690 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0080 -0.4330 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -0.4890 -1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 -0.9300 -0.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -0.4980 1.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -0.4780 2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -0.0440 2.5070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -1.0350 3.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -1.1370 4.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -1.7020 6.0200 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0110 -2.6490 5.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -1.9200 7.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -1.3520 8.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 1.9260 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 1.8560 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 1.9030 0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -0.8670 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -2.0270 3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -0.3790 3.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 -0.1520 5.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -1.7760 4.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -0.3850 -2.3990 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.4020 -2.5600 7.2110 O 0 5 0 0 0 0 0 0 0 0 0 0 1.6290 -0.7480 6.4240 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4590 -0.7450 7.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 0.2170 6.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -1.0890 6.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 M CHG 1 23 -1 M CHG 1 24 -1 M CHG 1 25 1 M END