CHEMDIV-ZINC04959939 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4210 -1.6190 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 -0.1510 1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2580 -0.9580 2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -0.3840 3.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2660 0.8870 3.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 1.4290 1.6710 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 -0.4390 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3270 0.2490 -2.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 0.4600 -3.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -0.2290 -2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4000 0.5540 -4.6690 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 2.0540 -0.6000 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -0.2970 0.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 -1.0950 2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -1.3970 3.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 -1.2050 2.3690 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8280 -1.6910 3.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3100 -1.7200 3.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0960 -0.6110 3.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4540 -0.6830 3.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9750 -1.8490 2.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1960 -2.8850 2.5080 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9020 -2.8540 2.7570 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 -1.9100 -1.9800 2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 -0.9260 4.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7770 1.4920 4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0450 -0.2110 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 -1.5170 -1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3480 -0.1320 -2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3470 1.3250 -2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 1.5380 -3.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 0.2320 -4.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 -1.3040 -2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 0.1520 -2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4700 1.6340 -4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4020 0.1260 -4.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 0.3340 -5.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -0.7310 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6170 -0.9640 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 -1.0250 4.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 -2.6960 3.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6620 0.2880 3.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0970 0.1620 3.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0320 -1.9140 2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2960 -3.7230 2.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 0.0480 -1.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -0.0280 -3.5450 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 54 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 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 11 54 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 12 55 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 13 55 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 54 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 15 55 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 28 53 1 0 0 0 0 M END