COMGENEX-ZINC06711903 MOE2007 3D Structure written by MMmdl. 43 45 0 0 0 0 0 0 0 0999 V2000 1.3380 8.2300 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 7.4210 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 5.9690 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 5.2350 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 3.8700 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 3.1420 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 1.7520 -0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 1.0360 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1430 1.7560 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 3.1530 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 3.5520 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 2.4170 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 1.3240 -0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 -0.0800 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1520 -0.6150 -1.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 -1.6050 -1.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 -2.1440 -3.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2410 -1.3460 -4.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4820 -1.8960 -5.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -3.2470 -5.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 -4.0480 -4.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4990 -3.4990 -3.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7440 2.4300 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2980 3.5140 0.4830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 9.2720 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 7.8780 1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 7.8210 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 5.6400 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 5.8330 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 3.6360 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 1.2130 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -0.0460 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8790 4.5660 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 -0.6420 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7330 -0.1840 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0060 -0.1590 -1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 -2.0770 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4290 -0.2860 -4.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8620 -1.2650 -6.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 -3.6730 -6.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5430 -5.1020 -4.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 -4.1420 -2.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3590 1.3680 -0.2130 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 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 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 M CHG 1 43 -1 M END