PUBCHEM-ZINC05469423 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 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 0.7130 -0.4910 1.1920 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7320 -1.9600 1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -2.4660 2.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 0.0180 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 -0.4760 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.0170 2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -0.5460 2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -0.0740 3.6170 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7220 1.1000 3.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 1.9160 2.8840 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3480 1.3700 5.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 2.4980 5.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5650 2.5390 6.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3880 1.4780 7.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6900 0.3560 7.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 0.3110 5.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -0.8910 5.0650 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 -2.0010 4.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -0.9850 5.6560 O 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 -0.2900 -2.3370 1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -2.3110 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -2.1150 3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 -3.5560 2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 -2.0890 2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 1.1080 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -0.3430 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8300 -0.0980 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 -1.5660 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 -0.1150 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -0.3780 3.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 1.0730 2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 -0.1860 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -1.6360 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2060 3.3360 4.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1080 3.4130 7.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7910 1.5220 8.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5460 -0.4780 7.9260 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 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 2 0 0 0 0 11 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 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 M CHG 1 3 1 M END