PUBCHEM-ZINC01997668 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 0 0 0 0 0 0999 V2000 0.5840 1.6700 -0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 0.1710 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -0.5870 -1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -2.0910 -1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -2.9640 -2.6520 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -4.6170 -2.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 -5.2670 -3.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -6.5780 -3.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -7.2540 -1.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -6.6030 -0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -5.2930 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -8.6460 -1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 -9.1670 -2.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -9.2670 -0.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -10.6710 -0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -11.2500 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2760 -10.8510 0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5980 -10.2210 0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1640 -10.8690 -0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1440 -10.8530 -1.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -11.4830 -1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 2.0610 -1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 1.9060 -0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 2.1910 0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8890 -0.0290 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -0.1830 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -0.3750 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -0.2190 -2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 -2.3030 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -2.4570 -0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -4.7610 -4.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 -7.0670 -3.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -7.0960 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -4.8120 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -11.1720 -1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -10.7990 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -12.3430 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -10.8520 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 -10.3000 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 -11.9060 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3210 -10.3130 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 -9.1480 0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 -11.9050 -0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0740 -10.3440 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 -11.3900 -2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 -9.8180 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -12.5440 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 -11.3700 -2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -10.7810 -0.1700 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1750 -9.7840 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 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 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END