PUBCHEM-ZINC00560019 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 0 0 0 0 0 0999 V2000 1.1650 0.0340 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -1.3440 -0.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -1.6240 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 -0.5940 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8020 -0.8810 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -2.1940 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3210 -3.2230 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -2.9400 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -4.6270 -0.1760 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9770 -5.5380 -0.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 -4.8730 -0.1920 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.9520 -2.5580 0.1350 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0710 -3.5290 1.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6260 -1.3070 0.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 -2.5900 -2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -1.5900 -2.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5160 -0.8880 -3.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4600 -1.1800 -4.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3940 -2.1760 -4.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3850 -2.8840 -3.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3030 -3.8640 -3.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2480 -4.1110 -4.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 0.1180 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 0.5630 -1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 0.4740 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 0.4320 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 -0.0800 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -3.7440 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7610 -1.3590 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7880 -0.1090 -4.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4700 -0.6290 -5.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1320 -2.4020 -5.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8260 -3.2050 -4.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7200 -4.4000 -5.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9210 -4.9140 -3.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4160 -3.3060 -1.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6750 -4.2410 -1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 36 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M END