CHEMSTAR-ZINC04555381 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 -0.9120 1.1790 -0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 1.3760 1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 1.9860 2.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 1.5900 3.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 1.0550 2.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4690 0.6600 2.9210 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0360 1.2660 4.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 1.7160 4.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 2.2690 5.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 2.8450 5.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7630 2.0720 6.8850 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 2.5040 8.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 3.2400 8.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 3.6440 9.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 3.3120 10.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1010 2.5770 10.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3370 2.1750 9.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 3.8140 12.4450 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.9390 1.2140 5.4920 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8160 2.1720 5.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8450 2.2740 6.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6340 3.4250 6.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6010 3.5540 7.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7790 2.5360 8.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9920 1.3850 8.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0230 1.2510 7.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6290 0.8000 0.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 0.1250 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 1.8170 -1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 1.3650 -1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 1.8810 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 0.3010 1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 1.6680 3.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 3.0800 2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6360 1.5500 6.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 3.5210 7.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 4.2180 10.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8130 2.3140 11.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2370 1.6040 8.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8100 2.9670 4.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5040 4.2290 5.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2140 4.4500 7.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5320 2.6400 9.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1360 0.5920 9.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4200 0.3470 7.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4430 -0.2670 0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 1.1490 0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 1.5460 0.4350 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6110 2.5450 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 48 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 48 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 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 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END