PUBCHEM-ZINC02919781 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 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 0.0230 -0.7020 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.0720 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2750 -0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2950 -4.6410 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -4.7710 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 -4.2090 1.5480 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1930 -3.1390 1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -4.4450 2.5880 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -4.7150 2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -4.8720 3.4940 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -4.7080 4.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -4.4450 3.9750 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -4.7890 1.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 -4.9020 1.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 -6.2710 2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 -6.9060 2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6650 -6.1720 2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6460 -4.8030 2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4660 -4.1680 2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8900 -4.0160 2.5590 N 0 3 0 0 0 0 0 0 0 0 0 0 7.9300 -4.5760 2.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8730 -2.8100 2.3930 O 0 5 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 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 0.2690 -2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.5200 -3.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.0160 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -5.8600 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -4.4360 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -4.7800 5.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 -5.1570 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -6.8450 1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 -7.9760 2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5870 -6.6680 2.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 -3.0990 1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END