COMGENEX-ZINC06777431 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 1.8140 1.8560 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 1.5740 1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 3.4270 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 3.7790 -1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 5.0230 -0.8900 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 5.1250 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 4.1870 0.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 6.5340 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 7.0800 -1.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9670 7.2040 -1.3220 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3690 6.1900 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2040 7.7490 -3.0370 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 8.1170 -3.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 7.5150 -2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 7.4100 -2.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6240 8.1590 -0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 9.3390 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5310 10.2110 0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7890 9.9240 1.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4730 8.7720 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9030 7.8880 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4980 6.7340 -0.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8420 6.4930 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7510 11.2880 1.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2260 12.1440 2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 0.8250 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 2.5640 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 2.0410 -2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 2.2350 1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 0.5390 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 1.6280 2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 4.1260 0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 3.4490 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 3.8950 -2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 2.9840 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 5.8640 -1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7740 6.5200 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1850 7.1900 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 7.6720 -4.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2990 9.1980 -3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9830 9.5830 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2720 10.5740 2.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4520 8.5910 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9040 6.3320 1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5040 7.3030 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1770 5.5750 -0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1550 12.6410 2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3540 11.5980 3.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4720 12.9190 2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 2.0210 -0.0500 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0720 1.3870 -0.2050 H 0 0 0 0 0 0 0 0 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 1 50 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 50 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 50 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 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 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 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 41 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END