PUBCHEM-ZINC05115424 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 0 0 0 0 0 0999 V2000 0.6890 0.0790 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 0.9170 3.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.7250 4.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 3.0500 2.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 2.2160 1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 3.9880 4.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8250 5.4560 4.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9330 6.3110 4.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7670 7.6920 3.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 8.2120 3.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 7.3740 3.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 6.0070 4.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 5.1570 4.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9670 8.6110 3.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6880 8.6860 5.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8620 7.9820 5.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5510 7.9720 6.6070 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0120 10.8760 6.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0850 8.6940 7.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8090 8.6840 8.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3960 9.3880 9.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1440 9.3640 11.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7120 10.0650 12.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5280 10.7960 12.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7760 10.8270 11.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2010 10.1290 9.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4630 10.1470 8.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8960 9.4480 7.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 9.4300 6.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0570 10.1360 6.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -0.9430 1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 0.5220 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -0.0020 0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 1.3560 3.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -0.1000 3.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9490 1.2570 4.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 1.8360 5.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 4.0740 1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 2.6110 2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 2.1510 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 2.7360 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 3.7950 5.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 3.6640 4.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 5.9040 4.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 9.2830 3.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 7.8060 3.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 5.7060 4.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6760 9.6230 3.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6510 8.2660 3.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3030 7.3760 4.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7280 8.1000 8.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0700 8.7970 11.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2980 10.0390 13.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1900 11.3410 13.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8540 11.4040 11.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 10.7060 8.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 0.8620 1.9740 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 3.1100 3.6370 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1820 3.5890 3.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 57 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 57 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 58 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 4 58 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 57 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 6 58 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 29 2 0 0 0 0 16 17 2 0 0 0 0 16 50 1 0 0 0 0 17 19 1 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 28 2 0 0 0 0 20 21 2 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 24 25 2 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END