PUBCHEM-ZINC06017594 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -2.5000 -2.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -2.7550 -2.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8610 -2.6660 -1.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1240 -3.0020 -2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3210 -3.4270 -3.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2600 -3.5200 -4.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 -3.1850 -3.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 -3.1740 -4.5280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -2.7770 -3.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -2.6200 -4.0350 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 -3.1450 -5.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 -3.0900 -6.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1980 -2.7300 -5.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5630 -3.4710 -7.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -3.8860 -8.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 -4.2430 -9.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 -4.1930 -10.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1180 -3.7790 -9.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8720 -3.4250 -8.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4200 -3.7340 -10.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6860 -4.3790 -11.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7970 -4.3300 -11.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5950 -5.1610 -11.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 -4.5450 -11.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9420 -3.8500 -4.0270 S 0 0 0 0 0 0 0 0 0 0 0 0 6.9410 -3.7010 -5.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8460 -3.1620 -3.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 -5.4650 -3.7280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 -2.3350 -0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9640 -2.9330 -1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4210 -3.8510 -5.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 -2.4810 -6.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -4.1660 -5.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -3.9250 -8.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 -4.5620 -10.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6840 -3.1100 -7.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1190 -3.2470 -9.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 -6.1820 -11.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7820 -5.1780 -12.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4400 -5.9810 -3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9920 -5.8960 -3.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 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 23 2 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 28 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 29 30 2 0 0 0 0 29 31 2 0 0 0 0 29 32 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 M END