PUBCHEM-ZINC06403262 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8150 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -2.5530 0.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -2.3880 2.5190 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0270 -2.0640 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -3.8930 2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -4.5740 3.3740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -3.8010 4.6640 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -3.1780 5.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -3.0870 4.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -5.0450 5.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -5.5760 6.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -6.5520 7.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -6.9960 7.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 -6.4640 6.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 -5.4850 5.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -8.0600 8.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 -1.9180 2.5290 N 0 3 0 0 0 0 0 0 0 0 0 0 3.3470 -1.2180 3.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 -0.7570 3.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5030 -1.0410 2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0130 -1.7800 1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -2.2100 1.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 -4.3970 1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 -5.2290 6.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -6.9670 8.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 -6.8110 6.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 -5.0670 4.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 -7.5910 9.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7130 -8.6480 7.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -8.7130 8.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -1.0010 4.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9980 -0.1840 4.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5260 -0.6940 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 -2.0190 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 -2.7900 0.6870 H 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 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 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 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 M CHG 1 20 1 M END