PUBCHEM-ZINC04544540 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 58 0 0 1 0 0 0 0 0999 V2000 -0.9300 -0.3740 1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -2.0410 0.9580 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -1.6250 -0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -2.9040 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 -2.6240 -2.6420 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4350 -2.0600 -2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 -3.9470 -3.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -4.4090 -4.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 -4.5650 -2.5350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 -5.8490 -2.8820 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8680 -6.4930 -3.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8710 -5.6930 -3.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5580 -5.5610 -5.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6110 -4.3130 -5.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3170 -4.1990 -7.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 -5.3300 -7.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9160 -6.5760 -7.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2100 -6.6930 -5.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0770 -6.4650 -1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 -5.7690 -0.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2770 -7.8220 -1.5960 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 -8.6490 -0.5090 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5700 -8.0580 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7370 -9.1650 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 -8.0510 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 -8.7490 2.5690 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -7.1950 3.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5060 -9.9220 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1800 -10.1650 -2.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -1.7830 -3.6340 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -1.9520 -4.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -2.7720 -3.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 0.2610 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 0.0650 0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -0.4250 2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -1.0840 -1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 -0.9710 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -3.4910 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -3.5380 -1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 -4.1430 -1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4660 -4.8300 -3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5400 -6.5570 -3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8750 -3.4230 -5.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 -3.2270 -7.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 -5.2390 -9.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 -7.4600 -7.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 -7.6740 -5.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0960 -8.3680 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -9.6820 -0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1810 -9.9100 1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 -7.4600 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -7.3920 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -6.5740 3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -6.6500 2.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -7.4120 4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 -1.0380 -4.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 -1.2180 -4.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2980 -10.5310 -0.3290 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 47 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 48 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 28 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 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 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 29 2 0 0 0 0 28 58 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 32 2 0 0 0 0 31 57 1 0 0 0 0 M CHG 1 58 -1 M END