PUBCHEM-ZINC05966880 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -0.2080 0.7760 -0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 1.3660 1.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 2.3440 2.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 2.1420 3.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 2.4600 4.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0190 2.2540 5.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 1.7220 4.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6810 1.4160 3.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3940 1.6550 2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 1.3610 1.1190 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2640 0.2850 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0200 2.1450 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 3.6280 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 4.1370 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7650 5.5010 -1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 6.3840 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8650 5.8870 0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1530 4.5200 1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8180 7.6900 -0.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 8.6370 0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2490 1.4950 4.8650 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 2.5140 6.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5390 3.0990 7.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 -0.2850 -0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 1.0450 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 1.0290 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 1.5500 1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 0.3190 2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 2.1840 3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 3.3790 2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 2.8570 5.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4700 1.0010 2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 1.6950 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0750 2.0170 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7410 3.4850 -1.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 5.8830 -2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2060 6.5350 1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7140 4.1690 1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 9.6260 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3460 8.6630 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 8.4370 1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2400 1.7740 5.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 3.2650 8.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 2.4250 7.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 4.0720 7.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 1.5830 0.7130 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5290 2.5760 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 46 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 2 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 46 1 0 0 0 0 12 13 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 19 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END