IBS-ZINC02310916 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -0.8320 -0.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 0.0610 0.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -2.1210 0.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3470 -1.0640 -1.6260 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2250 -0.2140 -2.4460 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8110 0.7910 -2.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2550 -0.8850 -3.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 -1.9680 -3.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9360 -2.1130 -2.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 -2.9030 -4.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4260 -4.0140 -4.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 -4.8820 -5.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 -4.6520 -6.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6290 -3.5500 -7.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8480 -2.6730 -6.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 -5.7480 -8.2680 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.6090 -0.1630 -1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1760 -1.3060 -1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4450 -1.2600 -0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1490 -0.0700 -0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5830 1.0730 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3150 1.0260 -1.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3370 2.3470 -1.2840 N 0 3 0 0 0 0 0 0 0 0 0 0 10.4550 2.3890 -0.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8380 3.3540 -1.7540 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8000 -0.5470 -4.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 -2.8370 -2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 -4.1950 -3.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 -5.7430 -5.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0960 -3.3760 -8.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4840 -1.8120 -6.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6260 -2.2360 -1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8880 -2.1530 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1410 -0.0330 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8740 1.9180 -2.2660 H 0 0 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 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 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 46 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 29 1 M CHG 1 31 -1 M END