COMGENEX-ZINC06770644 MOE2007 3D Structure written by MMmdl. 64 68 0 0 1 0 0 0 0 0999 V2000 -3.4440 -1.8910 2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1090 -0.9280 3.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5710 0.9540 2.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5730 2.4320 3.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7740 2.4960 4.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6130 1.5280 4.2350 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3590 1.0100 5.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 2.2330 3.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 1.3130 3.2530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 0.6650 4.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 1.6340 5.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 2.2040 4.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2610 3.0980 5.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8850 3.4060 6.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 2.8600 7.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 1.9730 6.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 3.2930 8.4170 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7030 4.1620 8.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 4.2460 7.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 1.0200 1.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 0.2150 1.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 1.7310 0.7840 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6220 1.8370 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 0.9120 -0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 1.5670 -1.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 3.0550 -1.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 3.7300 -2.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 5.1100 -2.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 5.8310 -1.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 5.1730 -0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 3.7870 -0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 3.1050 0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4760 -1.7710 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 -1.7450 1.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -2.9230 2.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 -1.1020 4.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7950 -1.0270 4.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2930 0.4100 3.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7260 0.7370 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5860 2.8270 3.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 3.0000 2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3900 2.1430 5.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 3.5120 4.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 2.9500 4.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 2.8340 2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 0.1740 5.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -0.1380 3.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 1.9400 3.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1520 3.5330 4.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 1.5560 6.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 5.1680 8.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 3.7900 9.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -0.1130 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 0.8320 -0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 1.0840 -2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 1.3950 -1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 3.1830 -3.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 5.6220 -3.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 6.9050 -2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 5.7490 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 3.0010 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 3.7480 1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1770 0.4960 3.2430 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5930 0.5310 2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 2 63 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 63 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 63 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 10 47 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 48 1 0 0 0 0 13 14 1 0 0 0 0 13 49 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 32 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 29 30 2 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 63 64 1 0 0 0 0 M CHG 1 63 1 M END