COMGENEX-ZINC06705964 MOE2007 3D Structure written by MMmdl. 44 46 0 0 1 0 0 0 0 0999 V2000 -4.2650 7.7630 3.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7370 6.3400 3.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 6.2020 2.6860 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 5.8140 1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 5.7890 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 6.1980 2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 6.4350 3.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 6.8470 4.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 7.0210 4.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 6.7970 3.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 6.3880 2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 5.4310 -0.2290 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7420 5.8360 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 5.9600 -1.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 7.4750 -1.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 7.9180 -1.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 3.9080 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 3.0670 -0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 1.6790 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 1.1040 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 1.9180 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 3.3090 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 1.4880 0.6190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 0.0820 0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 8.4620 3.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3760 8.0950 2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2430 7.8270 3.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4330 5.6540 2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6360 6.0060 4.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 5.5960 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 7.0350 5.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 7.3430 5.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 6.9450 4.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 6.2270 1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 5.5260 -2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 5.6930 -1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 3.4850 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 1.0430 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 0.0230 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 3.9330 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 -0.4010 1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5280 -0.3580 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -0.0920 0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 8.0970 -1.7850 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 M CHG 1 44 -1 M END