COMGENEX-ZINC06775537 MOE2007 3D Structure written by MMmdl. 41 43 0 0 1 0 0 0 0 0999 V2000 2.5640 9.5800 4.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 8.7540 3.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 8.0090 3.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 7.9290 4.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 7.1390 4.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 6.4290 3.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 6.4750 2.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 7.2840 2.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 5.6340 1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 5.1370 1.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 5.6080 3.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 5.3890 3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 5.4020 -0.1000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8890 5.7250 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 6.1630 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 7.6550 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 7.9600 -1.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 3.8840 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 3.1950 -0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 1.8100 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 1.0890 -0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 1.7440 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 3.1380 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 0.9490 0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -0.1130 1.3870 F 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 0.4200 -0.3410 F 0 0 0 0 0 0 0 0 0 0 0 0 2.9830 1.6650 1.4420 F 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 10.3140 4.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 8.9790 5.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4890 10.1320 4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 8.4800 5.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 7.0910 5.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 7.3670 1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 4.4860 1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 5.8090 -2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 6.0160 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 3.7290 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 1.2960 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 0.0100 -0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7230 3.6560 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 8.4070 -1.2360 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 M CHG 1 41 -1 M END