PUBCHEM-ZINC02047648 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -2.5850 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2290 -3.4280 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6430 -3.9490 -0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 -3.8550 -1.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -4.7800 -1.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -5.1750 -2.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -4.6580 -3.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -3.7410 -4.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 -3.3380 -3.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 -3.1930 -5.6370 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8680 -3.5500 -6.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 -2.3850 -5.8960 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6510 -6.1560 -2.3920 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7580 -6.6120 -1.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 -6.5070 -3.2680 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5110 -2.2730 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2810 -3.2820 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6660 -4.9460 -1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0050 -3.9960 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -5.1850 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -4.9720 -4.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3910 -2.4410 -3.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1300 -1.5190 -3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 35 36 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M CHG 1 17 1 M CHG 1 19 -1 M END