PUBCHEM-ZINC03871627 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 69 0 0 1 0 0 0 0 0999 V2000 0.2480 -0.5270 1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -0.0020 0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -0.3090 -0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -0.6810 0.4610 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4240 -0.5260 1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 -2.1810 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8880 -4.2520 -0.2250 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0300 -4.6420 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -4.4700 -1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8530 -3.9030 -2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 -2.5890 -2.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9040 -2.0680 -3.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0040 -2.8620 -3.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0280 -4.1770 -3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9500 -4.6980 -2.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1360 -4.9710 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1900 -4.3740 0.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0810 -6.2770 0.5450 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3100 -7.0030 0.8740 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1350 -6.6070 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1250 -8.4890 0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9430 -8.6740 -0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6110 -10.4210 -1.3060 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4280 -10.4380 -3.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6170 -6.8320 2.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8840 -6.1730 3.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 1.1150 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 1.6150 -1.3300 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0750 0.8850 -1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9160 2.9500 -0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1020 3.4710 -2.1950 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -0.0610 1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 -0.2870 2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 -1.6080 1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 1.0760 0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -1.3870 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 0.0660 -1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 0.1750 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 -2.3350 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -2.6260 1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 -3.9680 -2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 -5.5380 -1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9690 -1.9690 -2.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8850 -1.0420 -3.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8440 -2.4560 -4.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8870 -4.7970 -3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9680 -5.7260 -2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 -6.7370 0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2440 -8.8630 1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0040 -9.0420 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8510 -8.3630 -1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 -8.0670 -1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2220 -11.4550 -3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3490 -10.0830 -3.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6020 -9.7870 -3.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 1.8840 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 0.8950 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4320 2.8350 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1350 3.7040 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5670 4.6380 -1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0790 2.0670 -3.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0290 -2.8150 0.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6190 -2.6540 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7050 -7.4140 2.8700 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6870 -0.1040 -0.6370 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 0.0790 -1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4930 1.7990 -2.5510 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7560 2.4720 -2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8600 -7.2760 3.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 65 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 6 62 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 7 62 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 26 2 0 0 0 0 25 64 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 27 65 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 67 1 0 0 0 0 30 31 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 31 60 1 0 0 0 0 61 67 1 0 0 0 0 62 63 1 0 0 0 0 64 69 1 0 0 0 0 65 66 1 0 0 0 0 67 68 1 0 0 0 0 M END