PUBCHEM-ZINC06871662 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.1030 1.3210 -1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -0.1030 -1.0910 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -0.7810 -1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -0.2970 -1.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -2.2070 -0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9110 -3.0850 -0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6930 -4.4970 -0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -5.4000 -1.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -6.7200 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -7.1550 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -6.2470 1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 -4.9260 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -8.5660 0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -9.3400 -0.3850 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7760 -2.5100 -0.5900 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -0.8390 -0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -0.2940 -0.8930 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4930 -1.0950 -0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1430 -1.1390 0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2780 -1.9340 0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7280 -2.6490 -0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0250 -2.5260 -1.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9280 -1.7530 -1.8130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 1.7500 -1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 1.4810 -2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 1.8200 -0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 -2.7810 -0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 -5.0790 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -7.4140 -1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -6.5710 2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -4.2350 1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7710 -0.5670 1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8040 -1.9980 1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6030 -3.2850 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3380 -3.0620 -2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -8.8780 1.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 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 27 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 36 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 22 2 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 M CHG 1 14 -1 M END