PUBCHEM-ZINC01228840 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 0 0 0 0 0 0999 V2000 0.4680 1.1780 0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -0.3030 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 -1.1850 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -0.4520 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -0.7100 -1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 -0.6300 -1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 -0.9920 -2.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 -1.4510 -3.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -1.5290 -3.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -1.1640 -2.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7250 -1.9090 -5.2600 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -2.1050 -6.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8070 -0.9760 -5.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 -3.3920 -4.8920 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 -4.5070 -4.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 -5.7690 -4.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 -6.2290 -3.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6490 -7.3510 -3.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9920 -8.0060 -4.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5320 -7.5650 -5.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -6.4430 -5.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0720 -9.4430 -4.2200 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7070 -9.4600 -5.5350 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9650 -9.1010 -3.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1010 -10.6700 -3.9390 N 0 5 0 0 0 0 0 0 0 0 0 0 4.5370 -10.7740 -4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 1.3560 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 1.8310 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 1.5040 1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -0.9400 2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 -2.2480 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -1.0560 1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 0.1790 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 -1.4890 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 -0.1530 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 -0.2780 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 -0.9100 -2.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -1.8690 -4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -1.2430 -2.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 -3.3830 -4.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -4.3040 -3.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -4.6400 -5.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 -5.7100 -2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0220 -7.7090 -2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8130 -8.0810 -6.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -6.0800 -6.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 25 -1 M END