COMGENEX-ZINC06682680 MOE2007 3D Structure written by MMmdl. 59 63 0 0 1 0 0 0 0 0999 V2000 0.6620 0.3310 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 1.1020 1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 1.6270 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 1.4130 -0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 0.6600 -0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 0.1330 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -0.6520 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -1.8620 0.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5400 0.0160 0.3730 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7430 -0.8110 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2510 -1.1560 1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6570 -1.6310 1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7390 -2.7100 1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9840 -3.1440 2.4170 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8130 -3.7200 3.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6830 -2.6930 3.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 1.4810 0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 2.0070 -1.0840 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4760 1.3390 -1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4690 2.1670 -1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5870 3.6580 -1.8060 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.5950 4.0730 -1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6250 4.2930 -0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 3.4610 -1.2680 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4740 3.7070 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 3.7690 -2.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 3.8790 -3.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 2.1540 -1.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 2.4680 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 2.4130 0.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -0.1030 2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 1.2820 2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 0.4940 -1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 -0.2910 -0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5090 -1.7370 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 -1.6070 2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6170 -0.2670 2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9540 -0.7500 1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4320 -1.3510 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4620 -3.5730 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6760 -2.3070 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5140 -4.6040 2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0750 -4.0530 4.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7660 -3.1440 3.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9720 -1.8280 3.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5140 1.7450 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7990 1.9420 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7650 1.5040 -2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1070 1.9500 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4890 5.3730 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9040 4.1110 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 3.8310 -3.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1990 4.0500 -4.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 1.5660 -2.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 3.0710 -2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2440 1.7300 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8500 3.4590 -1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3810 -2.1660 1.6760 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.0560 -2.9710 1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 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 17 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 58 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 58 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 58 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 27 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 52 1 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 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END