PUBCHEM-ZINC02993601 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 0.7060 -1.8510 4.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -1.9760 3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -2.7450 3.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -2.8700 1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7100 -3.6000 1.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 -3.7970 0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -3.3730 -0.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5170 -4.5470 0.1910 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1020 -4.4800 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2300 -6.0180 -0.1380 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1560 -6.5900 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6790 -6.1160 -1.4890 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0100 -5.2600 -2.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5660 -5.4460 -3.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8160 -4.2030 -2.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3060 -3.9640 -0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4050 -3.2630 -0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2370 -6.5690 0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5490 -7.2280 1.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -7.6410 2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -7.3180 2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 -6.4490 0.7070 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -7.6440 2.8400 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0700 -8.2560 3.8920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -7.3010 2.2970 O 0 5 0 0 0 0 0 0 0 0 0 0 1.6460 -1.3030 4.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -1.3160 5.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -2.8460 5.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -0.9810 2.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -2.5110 2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -3.7400 3.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -2.2100 3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 -1.8750 1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 -3.4050 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 -6.8270 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0550 -3.6140 -2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7610 -3.0940 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9490 -2.8580 -1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5700 -7.4250 2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 -8.1840 3.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 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 10 1 0 0 0 0 8 16 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END