PUBCHEM-ZINC03870547 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 72 0 0 1 0 0 0 0 0999 V2000 -1.0760 1.5070 -7.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 1.6120 -5.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 1.1410 -5.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 0.8020 -5.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 1.3030 -5.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 0.8850 -4.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3050 -0.2340 -3.6890 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0480 -0.2330 -2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8420 -0.1490 -3.8710 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2690 -0.9320 -3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2800 -0.5200 -5.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2580 0.4350 -5.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6340 0.2950 -5.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5200 1.2760 -6.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0430 2.4040 -6.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6890 2.5060 -7.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7970 1.5310 -6.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9770 3.3520 -7.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5960 4.7120 -6.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4100 4.9950 -5.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9860 5.4460 -5.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6120 5.0950 -3.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6310 5.9180 -2.7520 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2480 3.7720 -3.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8420 3.2230 -2.2010 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1770 3.9720 -1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9840 1.9590 -2.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 1.7250 -1.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4660 1.0910 -3.3790 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0480 3.0030 -1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5900 2.5860 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0910 2.0120 -1.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 -1.4780 -4.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -2.2020 -3.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 1.9520 -7.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 0.4630 -7.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 2.0400 -7.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 2.6680 -5.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 0.0890 -5.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8920 1.2490 -4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4570 1.7340 -5.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 0.8530 -3.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -0.2570 -5.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 1.1520 -6.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 2.3570 -4.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 1.8740 -3.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 0.9200 -5.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7240 -1.5250 -5.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4120 -0.6210 -5.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0210 -0.5560 -5.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5840 1.1800 -5.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3080 3.3390 -7.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7390 1.6440 -6.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4380 5.3170 -7.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7400 5.0100 -7.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7070 4.1310 -4.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0880 5.8080 -5.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8890 6.5300 -5.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2470 4.9830 -5.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2500 3.1800 -4.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3900 1.2980 -3.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5620 3.9670 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4400 2.5550 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8620 3.2990 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1290 1.5920 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4310 2.2830 -2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9720 2.0100 -1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7060 0.9890 -1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 0.5240 -4.3150 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7700 0.5960 -3.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -0.4890 -4.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 5 69 1 0 0 0 0 6 7 1 0 0 0 0 6 46 1 0 0 0 0 6 47 1 0 0 0 0 6 69 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 11 12 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 52 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 58 1 0 0 0 0 21 59 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 30 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 61 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 62 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 32 66 1 0 0 0 0 32 67 1 0 0 0 0 32 68 1 0 0 0 0 33 34 1 0 0 0 0 69 70 1 0 0 0 0 69 71 1 0 0 0 0 M CHG 1 69 1 M END