PUBCHEM-ZINC02530703 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 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 -0.6980 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.1070 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7460 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -1.9620 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6470 -1.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -2.6300 -2.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.2180 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 -4.8390 -0.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -4.8740 -0.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -6.3220 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.8910 2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -3.2780 3.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -4.0090 4.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -4.3580 4.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -3.9770 4.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -3.2510 3.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 -2.8500 2.3820 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6170 -3.1650 2.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5410 -2.2050 1.3490 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0260 0.0320 2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 0.3180 3.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 0.3800 3.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 1.0950 4.3300 C 0 0 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 -1.0160 -2.8050 -2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -1.9860 -3.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -3.5820 -2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 -6.7250 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -6.7210 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -6.6090 -1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 -3.0060 2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 -4.3100 4.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -4.9300 5.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 -4.2510 4.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 2.0280 4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 0.4810 5.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 1.3140 4.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 22 1 0 0 0 0 4 5 1 0 0 0 0 4 13 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 8 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 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END