COMGENEX-ZINC06776516 MOE2007 3D Structure written by MMmdl. 56 58 0 0 1 0 0 0 0 0999 V2000 3.0240 2.4890 0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 4.5620 1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 3.7180 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 4.1540 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 4.4870 -0.7550 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 5.6700 -1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 6.4500 -1.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 5.8930 -2.4870 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2540 5.2170 -2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8250 5.6830 -3.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3950 6.7000 -4.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 7.8530 -3.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 7.2660 -2.5230 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5190 7.9190 -1.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8670 9.0900 -1.4380 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 7.1430 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8510 6.2190 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1120 5.5010 0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3350 5.7250 2.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 6.6620 2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 7.3760 0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 8.2680 0.9040 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 5.0250 3.1870 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.9550 8.4650 -4.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1760 9.9630 -4.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8990 10.7770 -4.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 10.2400 -3.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 8.7810 -3.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 2.2240 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 1.5850 -0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 3.0550 -0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 5.1960 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 5.0930 2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1160 4.2140 2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 4.4920 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 2.8230 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 3.3480 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 5.0320 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 3.8430 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 5.7850 -3.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 4.7010 -4.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4670 6.0650 -1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9220 4.7780 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 6.8340 2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8830 8.3040 -5.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8540 7.9160 -4.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6230 10.1600 -3.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9160 10.3150 -5.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0970 11.8240 -4.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 10.7620 -5.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 10.3570 -2.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 10.8370 -3.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 8.4190 -3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 8.7360 -4.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 3.3530 0.8490 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3890 2.7840 1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 55 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 55 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END