COMGENEX-ZINC06677663 MOE2007 3D Structure written by MMmdl. 52 54 0 0 1 0 0 0 0 0999 V2000 6.6220 3.3560 1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6590 2.8050 2.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4250 2.4950 1.9490 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 2.0100 2.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 1.8010 3.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 1.7120 2.0330 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0730 0.6520 1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6470 2.6650 1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 2.5280 2.3420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0820 3.3420 3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 1.8530 2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 2.7590 2.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 3.8700 2.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2420 3.8600 3.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 4.9650 4.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 6.3350 3.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 6.3460 3.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 5.2520 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 2.6750 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7910 3.6180 0.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 1.4240 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 0.1660 0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 -0.0410 -1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6290 1.2590 -1.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 2.3400 -2.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5830 3.6080 2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7900 2.6260 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2090 4.2540 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4840 3.5530 3.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 1.8950 3.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 2.2330 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 3.5890 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 1.5720 3.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 0.9280 1.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 3.6880 3.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9100 3.9940 2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 2.8860 3.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9900 4.7480 5.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5940 4.9780 4.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 7.0900 4.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7320 6.6130 3.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 6.2030 4.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 7.3250 3.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 5.2540 2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 5.5030 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 -0.2300 1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -0.4740 -2.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 1.9250 -3.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 2.8800 -2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 3.0170 -1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 -0.7080 -0.4920 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2160 -1.7150 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 46 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 51 2 0 0 0 0 24 25 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END