PUBCHEM-ZINC00527800 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 0.8870 1.5770 -1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 0.0590 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -0.5170 -0.4390 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4340 -0.0060 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -0.3020 -1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5830 0.5870 -0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 0.7830 -1.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 0.0950 -2.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9790 -0.7880 -3.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 -0.9860 -2.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -2.0090 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -2.6540 -0.5580 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -2.4840 0.7470 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -3.7890 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 -4.0270 2.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5650 -5.2930 2.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 -6.3440 2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 -6.1090 1.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -4.8410 0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9210 -7.7120 2.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 -8.4870 2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1420 -8.3820 2.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 1.9350 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 1.9080 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 2.0530 -0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -0.3840 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -0.2120 -0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 1.1410 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5110 1.4730 -1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8640 0.2470 -3.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 -1.3260 -4.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -1.6860 -2.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8470 -1.8250 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 -3.2370 2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4250 -5.4640 3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -6.9210 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -4.7150 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -8.2740 3.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2670 -7.6200 4.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 -9.1680 1.1920 O 0 5 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 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 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 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 33 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 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 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 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 M CHG 1 40 -1 M END