PUBCHEM-ZINC00268492 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 -0.0680 1.3060 -0.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.0710 -0.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6460 -0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -2.0400 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -3.0160 0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -4.2940 0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -4.6500 1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8550 -3.7190 0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 -2.4240 0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5630 -0.9810 0.3120 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 0.0300 -0.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 -6.0300 1.4790 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2500 -6.8540 1.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2850 -6.3430 1.7680 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0380 -2.6900 -0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 -3.6610 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -4.4650 -1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 -5.4510 -0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9120 -5.6380 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 -4.8380 1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 -3.8460 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 1.6390 -1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 1.4280 -1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 1.9020 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -5.0310 0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8670 -3.9960 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 -4.3200 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 -6.0780 -1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6640 -6.4090 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1730 -4.9860 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 -3.2190 2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 11 2 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 19 20 2 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 20 30 1 0 0 0 0 21 31 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END