PUBCHEM-ZINC02917453 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 65 0 0 1 0 0 0 0 0999 V2000 0.9550 1.6450 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 0.1720 -0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 -0.4310 0.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 -1.7640 0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -2.4480 -0.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -2.2700 2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -3.5560 2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 -4.0940 3.7590 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 -3.3890 4.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 -2.1020 4.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 -1.5750 5.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1930 -0.4730 5.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8830 -2.5580 6.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7070 -2.2480 7.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 -3.0690 8.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8910 -2.7500 9.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9120 -3.8330 10.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0580 -4.7860 9.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5270 -4.3300 8.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6360 -6.1100 10.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9730 -6.5330 11.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5940 -7.7920 12.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8740 -8.6520 11.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 -8.2700 10.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9040 -6.9900 9.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 -9.2210 9.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 -8.8230 8.0100 O 0 5 0 0 0 0 0 0 0 0 0 0 2.9580 -3.9820 6.1190 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 -1.3340 3.2670 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1360 -0.7930 2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -0.3190 3.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 1.0510 3.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 1.9970 4.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 1.5930 4.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 0.2300 4.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -0.7170 4.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 2.6100 5.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -4.5280 1.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 2.1280 0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 2.1540 -1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 1.7790 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -0.3030 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 0.0520 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1970 -1.2750 7.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4460 -1.8250 9.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4840 -3.9030 11.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5330 -5.8870 12.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 -8.1040 13.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 -9.6340 11.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 -6.6930 8.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 1.3960 3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 3.0520 4.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 -0.1050 5.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -1.7690 4.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 2.9200 4.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 2.2020 5.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 3.4930 5.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 -5.0380 0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -5.2920 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -4.0430 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 -10.3510 9.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 42 1 0 0 0 0 2 43 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 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 20 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 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 61 2 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 51 1 0 0 0 0 33 34 1 0 0 0 0 33 52 1 0 0 0 0 34 35 2 0 0 0 0 34 37 1 0 0 0 0 35 36 1 0 0 0 0 35 53 1 0 0 0 0 36 54 1 0 0 0 0 37 55 1 0 0 0 0 37 56 1 0 0 0 0 37 57 1 0 0 0 0 38 58 1 0 0 0 0 38 59 1 0 0 0 0 38 60 1 0 0 0 0 M CHG 1 27 -1 M END