COMGENEX-ZINC04734984 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 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 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8400 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.5620 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.4340 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 -3.8960 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 -4.6460 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0170 -4.1080 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8370 -5.9900 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 -6.6930 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -8.0500 0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3580 -8.5680 0.1230 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0230 -6.8610 0.0190 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6450 -6.6410 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8140 -6.6860 -1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1690 -6.3440 -2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8920 -6.1830 -3.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2620 -6.3640 -3.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9110 -6.7080 -2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1820 -6.8740 -1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2580 -6.8860 -2.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9430 -6.7030 -3.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4180 -6.9400 -3.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2460 -5.8890 -3.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5990 -6.1070 -2.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1230 -7.3750 -3.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2950 -8.4260 -3.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9430 -8.2080 -3.6160 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -2.1110 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -2.1010 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -4.3250 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 -6.8730 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -6.0830 0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9250 -8.7540 0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 -7.9120 1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0980 -6.2020 -2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3860 -5.9150 -4.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8260 -6.2370 -4.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6860 -7.1450 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7840 -5.6850 -4.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5580 -7.4090 -4.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8360 -4.8980 -2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2460 -5.2860 -2.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1800 -7.5460 -2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7040 -9.4170 -3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2960 -9.0280 -3.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 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 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 M END