PUBCHEM-ZINC06223555 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.6150 -1.5190 -2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -2.8950 -1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -2.7470 -0.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -3.8780 0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -5.1740 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -6.2370 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -6.0150 1.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -4.7200 2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -3.6600 1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 -4.4230 3.6810 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6620 -3.4530 3.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -4.3500 4.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -5.5540 5.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -5.5500 6.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 -4.3450 6.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -3.1250 6.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -3.1010 5.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -1.8180 4.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -0.6370 5.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -0.6930 6.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -1.9300 6.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3870 -5.3870 2.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6980 -5.6510 3.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5860 -4.8040 4.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 -5.0150 5.2630 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7260 -4.1160 5.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 -6.1870 6.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 -7.2280 5.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 -1.0680 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -1.5770 -3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 -0.8470 -1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 -3.3150 -1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -3.5400 -2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -5.3910 -1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -7.2460 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -6.8730 2.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 -2.6370 1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -6.5230 5.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 -6.4890 6.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -4.3670 7.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 -1.6930 4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 0.3270 5.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 0.2220 6.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -1.9510 7.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3970 -4.4120 2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1050 -6.1800 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7880 -6.7130 3.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5610 -5.3760 2.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3370 -5.0860 5.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7420 -3.7480 4.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3690 -5.3370 3.9560 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0150 -6.2970 4.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6210 -5.9790 7.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 -6.7920 7.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 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 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 51 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 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 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 51 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 51 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 51 1 M END