COMGENEX-ZINC04735733 MOE2007 3D Structure written by MMmdl. 40 40 0 0 1 0 0 0 0 0999 V2000 0.8420 2.6160 0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 1.8850 0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 0.4580 0.2960 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0620 0.4650 -0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 -0.1390 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -1.7470 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 -2.4430 1.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 -2.3180 1.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0100 -2.9420 2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -3.6890 3.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -3.8150 3.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -3.1930 2.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4800 -4.2570 4.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 -4.9910 5.6250 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 -4.0100 6.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 -6.2430 5.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7940 -5.3450 6.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8440 -6.0610 7.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 3.6600 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 2.1730 1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 2.6070 -0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 2.4720 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 1.8710 1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -1.1210 -0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 -0.2490 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 0.5040 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -2.3360 0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -1.6010 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 -1.7430 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0840 -2.8430 2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -4.3950 4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -3.3120 2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2430 -5.9650 5.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3290 -4.3930 6.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3890 -5.4540 8.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 -7.0120 7.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8800 -6.2690 7.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -0.3980 1.2060 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0600 -0.5130 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 0.0910 1.4220 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 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 38 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 M CHG 1 38 1 M END