PUBCHEM-ZINC05114790 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 1 0 0 0 0 0999 V2000 -1.3020 1.6210 -1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 0.1220 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 -0.4940 -1.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 -1.8500 -1.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -2.5450 -1.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -2.3350 -1.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -3.6380 -1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 -4.0160 -1.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -4.6630 -1.7990 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -6.1130 -1.8490 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5650 -6.3370 -2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -6.6820 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 -7.7160 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -8.2720 0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -7.7970 2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -6.7800 1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -6.2290 0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 -8.3140 3.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 -9.0460 3.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -6.8150 -2.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -6.1650 -2.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 2.0070 -1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 1.8620 -2.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 2.1370 -1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -0.1050 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1040 -0.2530 -2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 -1.5700 -1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2270 -4.6310 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 -4.5750 -2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 -3.1390 -1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -4.4050 -1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 -8.1030 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0920 -9.0720 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -6.4210 2.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 -5.4430 0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -7.9420 -2.9090 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 M CHG 1 36 -1 M END