CHEMDIV-ZINC00428715 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.0600 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -0.0920 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -1.2790 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 -2.5030 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -2.0880 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -3.0500 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 -4.3920 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 -4.7950 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8930 -3.8490 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2850 -6.5110 -0.0350 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 -6.6130 -0.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -7.1800 -0.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 -7.0050 1.5430 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 -6.4650 2.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5280 -7.3180 3.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 -7.1260 4.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 -8.0390 5.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0090 -8.9710 5.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5830 -8.7130 3.8390 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 0.5090 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6420 0.5190 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0820 -1.2650 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0980 -1.2560 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -2.7410 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -5.1300 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 -4.1620 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -7.6510 1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -5.4440 2.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3750 -6.4670 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1330 -6.3200 4.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 -7.9990 6.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3390 -9.7620 6.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 M END