COMGENEX-ZINC06689306 MOE2007 3D Structure written by MMmdl. 63 64 0 0 0 0 0 0 0 0999 V2000 5.9800 -0.7050 2.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4330 -2.0280 3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7760 -2.1240 4.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0320 -3.2400 2.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9800 -2.0560 3.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2950 -1.9960 2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 -1.8770 1.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 -2.0380 2.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -1.6610 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -0.1570 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 0.1950 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 2.0980 -0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 3.4710 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5440 5.0840 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 5.6830 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 4.6680 -0.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 4.8900 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -2.3440 3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -1.9220 3.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 -3.1940 4.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1730 -4.5770 4.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7510 -5.4640 5.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 -5.6020 6.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 -4.2400 6.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -3.3610 5.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4700 0.1470 3.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0550 -0.6110 3.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8280 -0.6130 1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3700 -3.0440 5.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8580 -2.1090 5.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3250 -1.2950 5.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 -3.1970 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1140 -3.3060 2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5700 -4.1700 3.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -2.2290 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -1.9330 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7230 0.3960 0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 0.1680 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 -0.4110 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 0.1060 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 2.1200 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 1.4070 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2970 5.4370 1.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 6.7080 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 4.5130 -2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 5.9560 -1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 4.3540 -1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 -2.6660 5.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -5.0710 3.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 -4.4920 3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 -5.0390 5.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9770 -6.4560 4.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -6.1800 7.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -6.1650 6.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -3.7360 7.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -4.3730 7.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -2.3790 6.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -3.8030 5.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3510 3.7300 0.9980 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.8960 3.0310 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 1.6240 0.5510 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1170 2.2260 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 1.7310 1.5540 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 4 1 0 0 0 0 2 5 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 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 18 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 11 61 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 12 61 1 0 0 0 0 13 16 1 0 0 0 0 13 59 2 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 14 59 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 59 60 1 0 0 0 0 61 62 1 0 0 0 0 61 63 1 0 0 0 0 M CHG 1 59 1 M CHG 1 61 1 M END