COMGENEX-ZINC06695546 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 69 0 0 1 0 0 0 0 0999 V2000 0.7750 0.1240 0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 0.2200 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 1.4700 1.1450 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5060 2.3460 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 1.6270 2.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 2.7640 3.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0230 2.9080 4.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 1.9150 4.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 0.7790 3.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0730 0.6370 2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 1.3330 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 0.2350 -0.5580 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 2.4300 -0.8790 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 2.2910 -2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3170 2.1480 -2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8670 2.0430 -0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2410 1.9120 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0630 1.8860 -1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5130 1.9910 -3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1390 2.1280 -3.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5820 2.2400 -4.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9600 1.0960 -5.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9680 3.5090 -5.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8000 1.8060 0.6580 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9810 2.3950 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5970 2.9540 0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5350 2.3610 2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8760 3.0970 2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7400 0.9080 2.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 3.7620 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 4.4840 -1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 4.5660 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 -0.7130 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -0.0300 -0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 1.0490 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 -0.6650 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 0.2820 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 3.5400 2.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0040 3.7960 4.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6590 2.0270 5.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7020 0.0030 3.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 -0.2500 1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 3.1740 -2.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 1.4060 -2.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2290 2.0620 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1310 1.7840 -1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1520 1.9700 -3.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0450 1.0560 -5.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5130 1.2090 -6.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6000 0.1750 -4.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 4.3400 -4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 3.5340 -6.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0550 3.5930 -5.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3360 1.3080 1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8360 2.8480 3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5760 2.6110 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2780 3.0730 3.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7310 4.1330 2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4390 0.4220 2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7840 0.3840 2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1410 0.8830 3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 3.6660 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 4.5210 -2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 5.4990 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 3.9480 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 4.0960 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9800 5.5840 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6990 4.5900 -1.2120 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 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 62 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 32 66 1 0 0 0 0 32 67 1 0 0 0 0 32 68 1 0 0 0 0 M END