COMGENEX-ZINC06835819 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.9200 -2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -1.3660 -3.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 -1.3810 -3.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7360 -0.9500 -2.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -0.5000 -1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -0.6340 2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 -0.3610 2.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -1.1330 3.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -1.2040 4.7560 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0510 -1.8160 4.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 0.1860 5.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 1.1460 5.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 2.4200 5.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 2.7350 5.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 1.7760 5.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 0.5020 5.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 2.1130 5.3140 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.2400 3.2360 5.6000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6750 1.2680 4.9770 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5050 -1.8180 5.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -1.3450 6.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 -2.1680 7.5980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -2.0320 8.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 -3.2160 7.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -3.0400 6.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -3.9610 6.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 -5.0290 7.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 -5.2050 8.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 -4.3120 8.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -0.9090 -2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -1.7030 -4.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5070 -1.7300 -4.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8150 -0.9620 -2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -0.1600 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -0.7070 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -2.1250 3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -0.4500 3.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 0.8990 5.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 3.1700 6.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 3.7310 6.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 -0.2460 4.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 -0.4480 6.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -3.8300 5.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -5.7410 7.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -6.0540 9.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 -4.4580 9.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 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 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 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 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 33 2 0 0 0 0 32 52 1 0 0 0 0 33 34 1 0 0 0 0 33 53 1 0 0 0 0 34 54 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END