COMGENEX-ZINC06869976 MOE2007 3D Structure written by MMmdl. 64 66 0 0 1 0 0 0 0 0999 V2000 2.7760 1.3980 2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 1.7860 1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 0.9030 1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 1.1780 0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 2.3470 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 3.2340 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 2.9650 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 3.9540 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 3.5550 -2.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 3.1140 -3.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6240 4.0440 -3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2330 4.2210 -4.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3210 5.0890 -4.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7810 5.8050 -3.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1990 5.5940 -2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1300 4.7020 -2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5530 4.4710 -0.9300 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2300 5.4530 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6340 3.8960 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3140 2.6830 -0.4020 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6650 1.5060 -0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4400 1.4200 -0.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5110 0.4860 -0.9880 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0400 -0.8540 -1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7110 -0.9520 -2.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0840 -1.8920 -0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8270 6.6930 -3.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9710 7.5310 -4.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9820 5.2650 -6.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5730 4.4930 -7.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 0.4330 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5750 2.1210 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 1.3120 3.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -0.0140 2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6780 0.4820 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 2.5690 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 4.1410 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 4.9450 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0210 4.0860 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7190 2.8320 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 4.5550 -2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8190 2.0960 -3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8720 3.1050 -4.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 3.6610 -5.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6010 6.1490 -1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4220 4.6400 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2010 3.6820 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3190 2.7160 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5060 0.6620 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1230 -1.0410 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9370 -0.2290 -3.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5930 -0.7440 -3.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3440 -1.9520 -3.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3080 -1.8250 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7280 -2.9050 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0230 -1.7400 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4810 8.4440 -4.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6080 7.0500 -5.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0060 7.8270 -5.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5480 4.7400 -7.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2300 4.7480 -8.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6840 3.4210 -6.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2840 3.5950 -0.8710 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6180 2.6080 -0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 8 63 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 9 63 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 63 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 63 64 1 0 0 0 0 M CHG 1 63 1 M END