COMGENEX-ZINC04924214 MOE2007 3D Structure written by MMmdl. 46 46 0 0 1 0 0 0 0 0999 V2000 -5.1260 3.1380 3.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3890 4.2590 3.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9570 3.8920 1.8300 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4010 2.9480 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1700 3.6210 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0050 4.9700 1.2550 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2650 5.2920 1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 4.4920 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 4.9130 -1.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 3.6440 0.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 3.1360 1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 1.6090 1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 1.0660 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 1.6570 -1.2020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5650 1.3140 -1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 3.1860 -1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 1.1990 -2.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 1.9100 -3.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -0.1150 -2.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -0.6620 -3.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -2.1230 -3.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5400 2.2140 3.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3070 3.4180 5.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0980 2.9350 3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4970 4.5080 3.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0250 5.1510 3.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7200 2.7380 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8680 4.4650 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8620 3.4240 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 3.5370 1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 3.4890 2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 1.2240 1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 1.2440 2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.0280 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 1.3030 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 3.5900 -1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 3.5980 -2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -0.1200 -4.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -0.5740 -3.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -2.2270 -4.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -2.5850 -4.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -2.6730 -3.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4870 6.4800 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1330 7.0130 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 6.2190 0.9090 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.2190 6.0770 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 45 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 43 45 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END