PUBCHEM-ZINC04395447 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 1 0 0 0 0 0999 V2000 0.1000 0.9120 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 1.3940 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 1.7790 -1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7540 2.2170 -2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 2.2650 -3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 1.8510 -3.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 1.4450 -2.4930 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6880 2.6620 -4.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 3.3890 -5.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2410 2.6190 -2.2640 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4590 3.4950 -2.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0350 1.4310 -2.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0520 0.8770 -1.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5560 -0.1440 -2.7180 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3000 -0.7810 -2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8580 -0.1440 -3.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9500 0.8100 -3.9370 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4860 1.3370 -0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0760 2.8150 -0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6870 1.7490 -0.0220 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3390 0.0100 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 0.6630 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 1.6900 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 1.8350 -4.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9770 1.7680 -5.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5560 3.3110 -4.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 3.6310 -6.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0630 -0.8560 -4.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5700 1.2380 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0030 0.7240 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6830 3.4790 -1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1660 3.1260 0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 1.1580 -2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6540 3.0380 -0.8570 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.9970 2.4370 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3150 3.9830 -0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 34 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 28 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 19 34 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 M CHG 1 7 1 M CHG 1 20 -1 M CHG 1 34 1 M END