PUBCHEM-ZINC05408396 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.2250 1.5930 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 0.1060 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 0.0980 1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 -0.4850 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 -1.5990 3.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -2.4160 2.5450 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4790 -2.2480 3.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -1.9100 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 -3.9540 2.5040 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3400 -4.7400 2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -4.8460 2.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 -5.6630 2.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -6.3570 0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 -6.2470 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -5.4360 0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -5.1740 0.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 -4.3000 1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -3.8390 1.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 -4.4720 3.8320 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3850 -3.6060 4.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1280 -2.0950 4.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 -1.8990 5.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 -1.7720 6.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 -1.3880 4.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3810 -0.8530 4.9840 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 -5.9100 3.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 -7.0480 3.7150 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 2.1850 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 1.9150 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 1.8310 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -0.4380 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -0.1330 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 1.1840 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 -0.1410 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7260 0.1110 2.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -2.2540 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -2.2300 1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -4.3270 3.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8300 -5.7720 2.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 -6.9910 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -6.7870 -0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -5.5650 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -4.3610 4.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -0.4020 1.1130 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2490 -0.0560 1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 -4.1860 4.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3010 -3.5720 4.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 44 1 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 26 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 46 2 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 3 0 0 0 0 24 25 3 0 0 0 0 26 27 3 0 0 0 0 44 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 44 1 M END