PUBCHEM-ZINC06352260 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 0.2410 -15.0590 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -13.7200 0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -12.6520 -0.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -11.3870 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -10.3020 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 -9.0180 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -8.8120 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -9.8920 1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -11.1780 1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 -7.1730 1.7270 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 -7.2520 2.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -6.3380 0.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -6.7300 2.5760 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -6.6140 1.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 -7.5960 2.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 -7.4840 1.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8990 -6.3840 0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9230 -5.4000 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7130 -5.5150 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2000 -6.2610 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5800 -5.2540 -0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8370 -5.5010 -1.3230 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.6240 -4.7960 -2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8760 -5.2260 -2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3530 -6.4210 -1.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5330 -7.1400 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2600 -6.6500 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2500 -7.1550 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2740 -7.9810 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -15.1520 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -15.8740 0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -15.1050 -0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -13.6280 1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 -13.6740 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -10.4620 -1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -8.1730 -0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 -9.7290 2.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -12.0210 2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 -6.5510 3.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2340 -8.4460 2.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3980 -8.2460 1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1170 -4.5480 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -4.7520 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9800 -4.3960 -1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2600 -3.8690 -2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4970 -4.6430 -3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3440 -6.7760 -2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8730 -8.0690 -0.6490 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 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 28 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 M CHG 1 22 1 M END