COMGENEX-ZINC04781837 MOE2007 3D Structure written by MMmdl. 58 60 0 0 1 0 0 0 0 0999 V2000 -0.9430 -2.6430 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.2790 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -0.2370 0.3410 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1730 -0.1850 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 1.1460 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -0.6040 1.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -0.2790 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 0.3340 0.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 -0.7310 2.2190 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8480 -1.7860 2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9170 0.1790 3.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5250 0.0740 4.2490 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4260 -0.6590 2.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8020 -2.1090 3.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6770 -2.7350 2.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8150 -1.8570 1.7650 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4920 -0.4640 1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 0.1870 2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3810 -2.2500 2.3320 S 0 0 0 0 0 0 0 0 0 0 0 0 9.5070 -3.6930 2.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3110 -1.4090 1.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4980 -1.8130 4.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6200 -2.1170 4.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8070 -1.8060 6.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4300 -0.5720 6.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6410 -0.3060 7.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2390 -1.2650 8.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6340 -2.4880 8.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4230 -2.7560 6.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -3.0690 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -3.3390 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -2.5720 -1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 -1.3890 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 -0.9350 -0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 1.8980 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 1.4550 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 1.1550 1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -1.0980 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7300 1.2210 3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -0.1360 4.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3570 -2.1390 4.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9130 -2.7350 3.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1040 -2.9100 1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0150 -3.7210 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9530 -0.4690 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3960 0.1280 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3630 1.1950 2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2790 0.3160 3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6560 -1.3180 4.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4390 -2.6420 4.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9830 0.2010 6.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3450 0.6530 8.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4040 -1.0560 9.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1060 -3.2340 8.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7330 -3.7180 6.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4420 -0.6080 1.7220 N 0 3 0 0 0 0 0 0 0 0 0 0 4.4830 0.3010 1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 -1.2990 0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 56 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 56 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 56 57 1 0 0 0 0 56 58 1 0 0 0 0 M CHG 1 56 1 M END