PUBCHEM-ZINC02785165 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 1 0 0 0 0 0999 V2000 0.8730 1.4560 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 0.0030 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -0.5090 1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -1.8380 1.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -2.8440 0.3370 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3730 -3.0770 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -3.8370 1.2520 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1440 -4.6910 1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 -2.6570 2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 -2.4950 3.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -4.2510 0.7980 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 -5.3340 1.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 -6.0500 2.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8560 -5.6060 0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5760 -6.6930 1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8710 -6.9720 0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4690 -6.1600 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7670 -5.0720 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4740 -4.8040 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8390 -3.7450 -0.6470 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.0570 -7.5150 2.2640 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 -2.3450 -1.2150 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -0.8020 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 0.4280 2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 0.3680 3.1750 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0600 2.0190 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7830 1.5330 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 1.9500 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -3.7010 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4030 -7.8250 1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4770 -6.3740 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2180 -4.4280 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.2060 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -1.0390 -1.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 1.1560 2.5090 O 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 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 22 23 1 0 0 0 0 23 33 1 0 0 0 0 23 34 1 0 0 0 0 24 25 1 0 0 0 0 24 35 2 0 0 0 0 M CHG 1 25 -1 M END