COMGENEX-ZINC06677148 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 71 0 0 1 0 0 0 0 0999 V2000 0.0950 2.0100 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 0.5510 -0.0480 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0740 0.1560 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 -0.2760 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -1.7280 -0.0970 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -2.4940 1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 -2.7620 1.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7100 -4.2660 2.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 -5.3060 4.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2070 -4.7690 5.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 -4.3750 5.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 -3.2850 4.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 -2.2680 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -1.5760 -2.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -3.7190 -1.4340 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9530 -3.9180 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 -4.7780 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -4.6420 -2.5470 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1860 -5.4050 -2.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -4.2490 -3.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -3.3460 -4.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9010 -3.0200 -5.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1560 -3.6110 -5.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5730 -4.5250 -4.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 -4.8410 -3.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 0.4900 1.2290 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 -0.4460 1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -1.3570 0.8130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -0.2080 2.8000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4940 -1.0510 3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8170 -0.9950 2.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 -0.4440 4.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 -2.4880 3.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 2.6030 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 2.0940 -1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 2.4580 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -0.0470 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -0.0020 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -3.4360 1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -1.9230 1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 -1.8510 1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -3.1670 0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0590 -4.6930 1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 -3.3810 3.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7760 -5.6050 4.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1810 -6.2070 3.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -3.9950 6.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 -5.2550 4.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 -2.3890 4.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 -3.0360 3.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -5.6480 -0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -4.4790 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -2.8790 -4.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 -2.3070 -6.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 -3.3650 -6.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 -5.0020 -4.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 -5.5770 -3.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 1.1690 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 0.0430 2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6200 -1.4980 3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 -1.4770 1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7730 -0.4320 5.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 -1.0000 5.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0380 0.6000 4.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8690 -2.9930 2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 -3.0880 4.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9990 -2.4980 4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2750 -3.7880 2.7130 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7270 -4.6100 2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 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 13 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 7 68 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 8 68 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 12 68 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 18 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 54 1 0 0 0 0 23 24 2 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 24 56 1 0 0 0 0 25 57 1 0 0 0 0 26 27 1 0 0 0 0 26 58 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 33 65 1 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 68 69 1 0 0 0 0 M CHG 1 68 1 M END