PUBCHEM-ZINC02855093 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 64 0 0 0 0 0 0 0 0999 V2000 -0.3930 1.0420 -2.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 0.0210 -1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 0.6460 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 1.2070 0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 1.8100 1.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 1.8590 2.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8530 1.3000 1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 0.6930 0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 0.1130 -0.2100 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 0.7450 -1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6690 1.4810 -1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8960 1.9130 0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5950 1.6420 -2.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9020 2.2290 -1.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0220 1.2500 -2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5040 0.2510 -3.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4260 1.2610 -3.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0120 -0.1470 -4.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1440 -0.2780 -5.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 -1.5680 0.0120 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -1.9580 1.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -2.2500 -1.1710 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8070 -1.7450 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5460 -1.1440 1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9320 -1.3020 1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5810 -2.0600 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8210 -2.6760 -0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4350 -2.5170 -0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0650 -2.2710 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 1.8250 -2.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 0.5500 -3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 1.5260 -2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -0.7440 -1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -0.5000 -1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 1.1720 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 2.2350 2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 2.3230 3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8470 1.3340 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5390 -0.0330 -2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 1.4720 -1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9930 3.1520 -2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9890 2.5010 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0020 1.7250 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9740 0.3430 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4100 -0.6870 -3.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4440 0.0580 -5.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4330 0.8590 -3.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5220 2.1770 -4.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8040 -1.1080 -3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9390 0.2680 -3.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2800 -0.7820 -5.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2560 0.7010 -6.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0290 -0.8750 -5.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0550 -0.5550 1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5010 -0.8380 1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3050 -3.3000 -1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8620 -3.0160 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2920 -3.1650 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4850 -2.3910 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5630 -1.4090 0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8970 0.8110 -3.6730 N 0 3 0 0 0 0 0 0 0 0 0 0 8.0180 1.6580 -4.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 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 36 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 61 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 16 61 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 18 61 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 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 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END