PUBCHEM-ZINC04585317 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 0.8630 0.7810 0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -0.4110 0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -0.8720 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 -1.9650 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 -2.5960 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 -2.1350 -1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -1.0390 -0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -2.8240 -2.6300 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2860 -3.3090 -2.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -1.8580 -3.6440 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -2.0830 -4.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 -3.6030 -4.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -4.0530 -2.5060 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -0.6100 -4.1690 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7130 -0.2660 -3.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 0.3200 -4.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 -1.2500 -5.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 -1.2970 -5.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1120 -1.7990 -6.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6160 -2.2570 -7.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2310 -2.2230 -7.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -1.7080 -6.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -1.6690 -6.8580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -2.0950 -7.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -2.6070 -9.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6780 -2.6870 -8.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -3.7890 -0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 0.4520 1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 1.2660 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 1.4860 1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -0.3780 2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 -2.3250 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 -0.6760 -1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 -1.7190 -5.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -1.5480 -3.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -4.1280 -4.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8320 -3.7820 -4.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 -0.9400 -4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1770 -1.8250 -6.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2830 -2.6440 -8.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 -2.0470 -8.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -2.9500 -9.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 -3.0820 -9.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 -3.4620 -1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 -4.4990 -1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7480 -4.2670 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 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 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 M END