PUBCHEM-ZINC03995581 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 41 0 0 1 0 0 0 0 0999 V2000 1.0300 0.8540 2.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -0.4120 2.1840 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1220 -1.2740 2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 -0.3280 0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -1.0370 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -0.9260 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 -1.5840 -1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6110 -1.3090 -3.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3780 -2.6120 -1.1960 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8060 -3.1270 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8880 -3.7260 -2.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4380 -3.3700 -0.2390 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5270 -3.2800 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6800 -2.0740 -0.5440 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4440 -1.5400 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4800 -1.1380 -1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8350 -0.7550 -0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.1080 0.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0540 -4.1670 1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7010 -5.3510 0.6910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 -0.5640 2.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 0.3330 1.6830 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 0.9690 2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 1.7560 2.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 0.8180 3.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 0.3590 0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -1.7110 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -0.2210 -1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9630 -0.4960 -3.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6360 -1.0200 -3.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3470 -2.1980 -3.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1630 -4.5320 -2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2480 -3.3730 -3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6500 -1.5950 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9210 -0.2110 -1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 -4.2880 -1.4250 N 0 3 0 0 0 0 0 0 0 0 0 0 6.8900 -4.5010 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8180 -5.1570 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8150 -1.3710 -1.3830 O 0 5 0 0 0 0 0 0 0 0 0 0 6.1520 -3.6120 2.1580 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2880 -1.5700 2.9130 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 12 36 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 M CHG 1 36 1 M CHG 1 39 -1 M CHG 1 40 -1 M CHG 1 41 -1 M END