IBS-ZINC01795897 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 34 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -0.7060 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -2.0860 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7720 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -2.0600 -1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -0.6800 -1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.2560 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -4.9580 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -6.2960 1.1490 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0980 -6.9500 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -6.2500 -1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -4.9200 -1.1790 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0290 -4.3020 -2.2290 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0800 -7.2050 -2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -8.5700 -1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -8.4370 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -7.0240 2.3630 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9180 1.8760 0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 1.8700 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 1.8510 0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -0.1730 1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -2.6330 1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -2.5870 -1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -0.1280 -1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -4.4300 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -6.8830 -3.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 -7.2680 -2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -8.7110 -1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -9.3850 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -8.8340 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -8.9570 0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 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 22 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 M CHG 1 10 1 M CHG 1 13 1 M CHG 1 14 -1 M CHG 1 18 -1 M END