CHEMSTAR-ZINC04554078 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 1.4730 1.7500 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 0.3380 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -0.2430 1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -1.5720 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -2.3620 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -1.7630 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -0.4410 -1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -2.4500 -2.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -3.8330 0.0970 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6220 -4.4090 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 -4.1280 1.3650 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 -4.4460 1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9810 -4.6800 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3490 -5.0030 0.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 -4.9710 1.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 -4.6170 2.7860 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.9060 -5.2460 2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6640 -5.9640 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4490 -5.3160 -0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4370 -5.5130 2.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8750 -4.4530 3.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5230 -6.9200 2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -4.5900 -1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -4.2280 -1.1530 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 -4.9190 -2.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 1.7700 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 2.2130 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 2.3610 0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 0.3360 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -1.9700 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -0.0250 -2.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 -3.2810 -2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -4.0840 2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9050 -6.2490 2.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1310 -4.4990 3.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5300 -5.9540 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4470 -6.9940 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7610 -4.3850 -0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0940 -5.9980 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0960 -5.4430 1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7630 -3.4450 2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9320 -4.5900 3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3040 -4.5100 3.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5600 -7.1520 2.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1950 -7.6780 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9270 -7.0260 3.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 -4.8350 -2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0400 -5.1880 1.5000 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.0760 -4.2020 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 48 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 40 1 0 0 0 0 20 48 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END