PUBCHEM-ZINC05456327 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 1.5880 -0.7020 3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -2.6980 3.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 -3.2670 4.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -3.1750 5.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -0.8020 5.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 -0.9090 4.6930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 0.4210 6.5560 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 0.5340 7.8190 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4700 -0.4520 8.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 1.6180 8.3730 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 -0.1120 -3.1930 3.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -2.9010 2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -4.3120 4.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 -2.7050 4.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -3.3240 5.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -3.9440 6.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -0.7940 4.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 1.2060 6.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -1.8460 6.5140 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