PUBCHEM-ZINC05456368 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -0.7040 2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -0.5010 2.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -1.2040 3.5390 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3810 -1.9500 3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -0.0450 4.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 -0.4860 5.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -0.9820 6.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.7540 5.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 -1.8150 4.4120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 -4.0710 5.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -5.0310 6.0950 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7650 -4.7000 7.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -6.1980 5.9510 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 0.4280 3.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 0.6840 4.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -1.2900 5.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.3580 5.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -0.8620 7.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -0.4020 6.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -1.5610 4.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 -4.3340 4.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -2.4070 6.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 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 3 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 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 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 33 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END