PUBCHEM-ZINC01002073 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 -0.2900 1.2730 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -0.2290 -0.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9860 -0.7580 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -0.7140 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8910 -1.1400 -1.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -0.6750 -2.4630 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 -1.1270 -3.5600 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -1.0890 -4.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.5450 -5.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -1.5630 -7.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -2.0910 -7.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8630 -2.3690 -7.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 -2.0350 -5.8300 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2430 -2.9730 -7.4510 N 0 3 0 0 0 0 0 0 0 0 0 0 4.4930 -3.2360 -8.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 -3.1840 -6.5870 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.6000 2.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -0.3700 2.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 -0.4920 3.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -0.8490 4.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -1.0800 4.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -0.9600 3.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 -0.9780 5.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 -1.0800 6.7950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 1.8020 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 1.4630 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 1.6240 0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -0.3350 -2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 -0.7100 -4.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -1.2350 -7.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 -2.2470 -9.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -0.0940 1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2020 -0.3130 3.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 -1.3560 5.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 -1.1420 3.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 24 25 3 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END