COMGENEX-ZINC04977431 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -0.1370 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 0.5050 -2.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 -0.4970 -1.4790 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 -0.1120 -2.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 -1.2010 -3.7760 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2680 -2.1480 -3.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5620 -0.8010 -5.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4200 -0.7840 -6.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 -1.6760 -5.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 -1.3410 -4.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1270 -1.2740 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8140 -0.3350 0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7110 0.8640 0.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5420 -0.8280 1.5120 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1750 0.0370 2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8970 -0.3310 3.4080 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4260 0.6270 4.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1380 1.8640 3.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1100 1.7440 2.3110 S 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 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -1.6200 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -0.1110 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1450 0.0100 -2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6630 0.8290 -3.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3170 -1.5400 -5.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0110 0.1880 -4.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7500 -1.2190 -7.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0460 0.2290 -6.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 -2.7310 -5.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -1.4300 -5.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8700 -1.9040 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 -1.9000 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6230 -1.7880 1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0430 0.4260 5.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4730 2.7800 4.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 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 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 18 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 23 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 M END