PUBCHEM-ZINC06521444 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 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 0.0220 -0.6940 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.0620 1.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7260 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.9420 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0630 -1.2050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.7150 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.1140 -2.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.8090 -2.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 -3.0890 -2.8910 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1490 -3.1840 -2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 -3.9360 -4.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 -2.5240 -4.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.8120 2.3950 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0270 -3.8790 2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -2.5300 3.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -1.9510 4.5100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9480 -0.8610 4.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -2.4610 4.6020 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5690 -3.4910 4.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 -2.3820 3.2390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -1.5580 5.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -2.1140 5.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 -2.4840 5.6070 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 -2.2220 5.6780 N 0 3 0 0 0 0 0 0 0 0 0 0 3.9090 -1.9590 5.7500 N 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 -0.1690 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -2.2210 -3.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.7530 -2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -4.2980 -4.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 -4.5920 -4.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9370 -3.4530 3.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 -1.8000 2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -1.4840 6.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -0.5650 5.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 -1.5920 6.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 15 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 25 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 26 27 2 0 0 0 0 M CHG 1 26 1 M CHG 1 27 -1 M END